List of recent publications by Prof. Franco Gianturco
| 2021 | |
|---|---|
| M. Simpson, M. Noetzold, T. Michaelsen, R. Wild, F. A. Gianturco and R. Wester Influence of a Supercritical Electric Dipole Moment on the Photodetachment of C3N- Phys. Rev. Lett. 127 (2021) doi:10.1103/PhysRevLett.127.043001 | |
| F. A. Gianturco, K. Giri, L. Gonzalez-Sanchez, E. Yurtsever, N. Sathyamurthy and R. Wester Efficiency of rovibrational cooling of HeH+ by collisions with He: Cross sections and rate coefficients from quantum dynamics J. Chem. Phys. 155 (2021) doi:10.1063/5.0062147 | |
| F. A. Gianturco, K. Giri, L. Gonzalez-Sanchez, E. Yurtsever, N. Sathyamurthy and R. Wester Energy-transfer quantum dynamics of HeH+ with He atoms: Rotationally inelastic cross sections and rate coefficients J. Chem. Phys. 154 (2021) doi:10.1063/5.0040018 | |
| B. Mant, E. Yurtsever, L. Gonzalez-Sanchez, R. Wester and F. A. Gianturco Vibrational quenching of CN- in collisions with He and Ar J. Chem. Phys. 154 (2021) doi:10.1063/5.0039854 | |
| L. Gonzalez-Sanchez, E. Yurtsever, B. P. Mant, R. Wester and F. A. Gianturco Collision-driven state-changing efficiency of different buffer gases in cold traps: He(S-1), Ar(S-1) and p-H-2((1)sigma) on trapped CN-((1)sigma) Phys. Chem. Chem. Phys. 23, 7703-7713 (2021) doi:10.1039/d0cp03440a | |
| L. Gonzalez-Sanchez, E. Yurtsever, R. Wester and F. A. Gianturco Dynamics of HeHHe+ Rotational State Changes Induced by Collision with He: A Possible New Path in Early Universe Chemistry J. Phys. Chem. A 125, 3748-3759 (2021) doi:10.1021/acs.jpca.1c01820 | |
| E. S. Endres, S. Ndengue, O. Lakhmanskaya, S. Lee, F. A. Gianturco, R. Dawes and R. Wester Temperature-dependent rotationally inelastic collisions of OH- and He Phys. Rev. A 103 (2021) doi:10.1103/PhysRevA.103.052807 | |
| B. Mant, J. Franz, R. Wester and F. A. Gianturco Beyond the helium buffer: C-12(2)- rotational cooling in cold traps with H-2 as a partner gas: interaction forces and quantum dynamics Mol. Phys. 119 (2021) doi:10.1080/00268976.2021.1938267 |
| 2020 | |
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| A. D. Doerfler, E. Yurtsever, P. Villarreal, T. Gonzalez-Lezana, F. A. Gianturco and S. Willitsch Rotational-state-changing collisions between N-2(+) and Rb at low energies Phys. Rev. A 101 (2020) doi:10.1103/PhysRevA.101.012706 | |
| B. P. Mant, F. A. Gianturco, L. Gonzalez-Sanchez, E. Yurtsever and R. Wester Rotationally inelastic processes of C-2(-) ((2)Sigma(+)(g)) colliding with He (S-1) at low temperatures: ab initio interaction potential, state changing rates and kinetic modelling J. Phys. B 53 (2020) doi:10.1088/1361-6455/ab574f | |
| J. Franz, B. P. Mant, L. Gonzalez-Sanchez, R. Wester and F. A. Gianturco Rotational state-changing collisions of C2H- and C2N- anions with He under interstellar and cold ion trap conditions: A computational comparison J. Chem. Phys. 152 (2020) doi:10.1063/5.0011585 | |
| E. Yurtsever, M. Satta, R. Wester and F. A. Gianturco On the Formation of Interstellar CH- Anions: Exploring Mechanism and Rates for CH2 Reacting with H- J. Phys. Chem. A 124, 5098-5108 (2020) doi:10.1021/acs.jpca.0c02412 | |
| B. P. Mant, M. Noetzold, L. Gonzalez-Sanchez, R. Wester and F. A. Gianturco Photodetachment in cold ion traps Rotational state selective C(2)H(-)losses from quantum dynamics Eur. Phys. J. D 74 (2020) doi:10.1140/epjd/e2020-10043-6 | |
| L. Gonzalez-Sanchez, B. P. Mant, R. Wester and F. A. Gianturco Rotationally Inelastic Collisions of CN(-)with He: Computing Cross Sections and Rates in the Interstellar Medium Ap. J. 897 (2020) doi:10.3847/1538-4357/ab94a0 | |
| S. Jerosimic, M. Milovanovic, D. Koprivica, R. Wester and F. A. Gianturco Structural properties of possible interstellar valence anions of the series HCnN-(n=3, 5, 7, 9) Phys. Chem. Chem. Phys. 22, 17263-17274 (2020) doi:10.1039/d0cp02666b | |
| B. P. Mant, F. A. Gianturco, R. Wester, L. Gonzalez-Sanchez and E. Yurtsever Thermalisation of C-2(-) with noble gases in cold ion traps Int. J. Mass. Spectrom. 457 (2020) doi:10.1016/j.ijms.2020.116426 | |
| M. Simpson, M. Noetzold, A. Schmidt-May, T. Michaelsen, B. Bastian, J. Meyer, R. Wild, F. A. Gianturco, M. Milovanovic, V. Kokoouline and R. Wester Threshold photodetachment spectroscopy of the astrochemical anion CN- J. Chem. Phys. 153 (2020) doi:10.1063/5.0029841 | |
| B. P. Mant, F. A. Gianturco, R. Wester, E. Yurtsever and L. Gonzalez-Sanchez Rovibrational quenching of C-2(-) anions in collisions with He, Ne, and Ar atoms Phys. Rev. A 102 (2020) doi:10.1103/PhysRevA.102.062810 |
| 2019 | |
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| L. Gonzalez-Sanchez, S. Gomez-Carrasco, A. M. Santadaria, R. Wester and F. A. Gianturco Collisional Quantum Dynamics for MgH- ((1)Sigma(+)) With He as a Buffer Gas: Ionic State-Changing Reactions in Cold Traps Front. Chem. 7 (2019) doi:10.3389/fchem.2019.00064 | |
| F. A. Gianturco, A. D. Dorfler, S. Willitsch, E. Yurtsever, T. Gonzalez-Lezana and P. Villarreal N-2(+)((2)Sigma(g)) and Rb(S-2) in a hybrid trap: modeling ion losses from radiative association paths Phys. Chem. Chem. Phys. 21, 8342-8351 (2019) doi:10.1039/c8cp06761a | |
| S. V. Jerosimic, R. Wester and F. A. Gianturco HCnN anions in the ISM: exploring their existence and new paths to anionic carbonitriles for n=3, 5 Phys. Chem. Chem. Phys. 21, 11405-11415 (2019) doi:10.1039/c9cp00877b | |
| F. A. Gianturco, E. Yurtsever, M. Satta and R. Wester Modeling Ionic Reactions at Interstellar Temperatures: The Case of NH2- + H-2 double left right arrow NH3 + H- J. Phys. Chem. A 123, 9905-9918 (2019) doi:10.1021/acs.jpca.9b07317 | |
| F. A. Gianturco, L. Gonzalez-Sanchez, B. P. Mant and R. Wester Modeling state-selective photodetachment in cold ion traps: Rotational state "crowding” in small anions J. Chem. Phys. 151 (2019) doi:10.1063/1.5123218 | |
| S. V. Jerosimic, M. Z. Milovanovic, R. Wester and F. A. Gianturco Dipole-bound states contribution to the formation of anionic carbonitriles in the ISM: Calculations using multireference methods for C3N- 80, 47-86 (2019) doi:10.1016/bs.aiq.2019.06.006 |
| 2018 | |
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| M. H. Vera, R. Wester and F. A. Gianturco The H-2(+) + He proton transfer reaction: quantum reactive differential cross sections to be linked with future velocity mapping experiments J. Phys. B 51 (2018) doi:10.1088/1361-6455/aa97b0 | |
| S. V. Jerosimic, F. A. Gianturco and R. Wester Associative detachment (AD) paths for H and CN- in the gas-phase: astrophysical implications Phys. Chem. Chem. Phys. 20, 5490-5500 (2018) doi:10.1039/c7cp05573k | |
| A. Kaiser, J. Postler, M. Oncak, M. Kuhn, M. Renzler, S. Spieler, M. Simpson, M. Gatchell, M. K. Beyer, R. Wester, F. A. Gianturco, P. Scheier, F. Calvo and E. Yurtsever Isomeric Broadening of C-60(+) Electronic Excitation in Helium Droplets: Experiments Meet Theory JOURNAL OF PHYSICAL CHEMISTRY LETTERS 9, 1237-1242 (2018) doi:10.1021/acs.jpclett.8b00150 | |
| M. H. Vera, E. Yurtsever, R. Wester and F. A. Gianturco NH2- in a cold ion trap with He buffer gas: Ab initio quantum modeling of the interaction potential and of state-changing multichannel dynamics J. Chem. Phys. 148 (2018) doi:10.1063/1.5022633 | |
| L. Gonzalez-Sanchez, R. Wester and F. A. Gianturco Modeling Quantum Kinetics in Ion Traps: State-changing Collisions for OH+((3)Sigma(-)) Ions with He as a Buffer Gas CHEMPHYSCHEM 19, 1866-1875 (2018) doi:10.1002/cphc.201800119 | |
| L. Gonzalez-Sanchez, R. Wester and F. A. Gianturco Rotational `cooling ́and `heating ́of OH+((3)Sigma(-)) by collisions with He: quantum dynamics revealing propensity rules under ion trap conditions Mol. Phys. 116, 2686-2697 (2018) doi:10.1080/00268976.2018.1442597 | |
| L. Gonzalez-Sanchez, R. Wester and F. A. Gianturco Collisional cooling of internal rotation in MgH+ ions trapped with He atoms: Quantum modeling meets experiments in Coulomb crystals Phys. Rev. A 98 (2018) doi:10.1103/PhysRevA.98.053423 | |
| F. A. Gianturco, O. Y. Lakhmanskaya, M. H. Vera, E. Yurtsever and R. Wester Collisional relaxation kinetics for ortho and para NH2- under photodetachment in cold ion traps Faraday Disc. 212, 117-135 (2018) doi:10.1039/c8fd00078f | |
| Z. Bacic, D. Benoit, M. Besemer, J. Bowman, S. Bradforth, D. Clary, R. Donovan, I. Fischer, F. Gianturco, M. Hochlaf, P. Houston, P. Knowles, S. Leone, R. Linguerri, U. Manthe, A. B. McCoy, J. Petersen, J. Richardson, X. Shan, P. Slavicek, T. Stoecklin, K. Szalewicz, A. van der Avoird, R. Wester, G. Worth and A. Zehnacker-Rentien Precise characterisation of isolated molecules: general discussion Faraday Disc. 212, 137-155 (2018) doi:10.1039/C8FD90050G | |
| D. Babikov, D. Benoit, J. Bowman, T. Burd, D. Clary, R. Donovan, I. Fischer, F. Gianturco, M. Hochlaf, S. Kar, A. Kirrander, S. Leone, T. Malcomson, U. Manthe, A. B. McCoy, J. Petersen, J. Richardson, P. Slavicek, T. Stoecklin, K. Szalewicz, A. van der Avoird, R. Wester, G. Worth and A. Zehnacker-Rentien Quantum dynamics of isolated molecules: general discussion Faraday Disc. 212, 281-306 (2018) doi:10.1039/C8FD90052C | |
| Z. Bacic, D. Benoit, M. Biczysko, J. Bowman, S. Bradforth, T. Burd, G. Chambaud, D. Clary, C. Crepin, M. Dracinsky, P. Felker, I. Fischer, F. Gianturco, M. Hochlaf, K. Kouril, I. Kratochvilova, C. Liu, A. McCoy, J. Miyazaki, H. Mouhib, J. Richardson, P. Slavicek, T. Stoecklin, K. Szalewicz, A. van der Avoird and A. Zehnacker-Rentien Molecules in confinement in clusters, quantum solvents and matrices: general discussion Faraday Disc. 212, 569-601 (2018) doi:10.1039/C8FD90053A |
| 2017 | |
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| M. H. Vera, F. A. Gianturco, R. Wester, H. da Silva Jr., O. Dulieu and S. Schiller Rotationally inelastic collisions of H-2(+) ions with He buffer gas: Computing cross sections and rates J. Chem. Phys. 146 (2017) doi:10.1063/1.4978475 | |
| S. Schiller, I. Kortunov, M. H. Vera, F. Gianturco and H. da Silva Jr. Quantum state preparation of homonuclear molecular ions enabled via a cold buffer gas: An ab initio study for the H-2(+) and the D-2(+) case Phys. Rev. A 95 (2017) doi:10.1103/PhysRevA.95.043411 | |
| M. H. Vera, S. Schiller, R. Wester and F. A. Gianturco Rotationally inelastic cross sections, rates and cooling times for para-H-2(+), ortho-D-2(+) and HD+ in cold helium gas Eur. Phys. J. D 71 (2017) doi:10.1140/epjd/e2017-70740-7 | |
| I. Iskandarov, F. A. Gianturco, M. H. Vera, R. Wester, H. da Silva Jr. and O. Dulieu Shape and strength of dynamical couplings between vibrational levels of the H-2(+), HD+ and D-2(+) molecular ions in collision with He as a buffer gas Eur. Phys. J. D 71 (2017) doi:10.1140/epjd/e2017-80043-8 | |
| L. Gonzalez-Sanchez, S. Gomez-Carrasco, A. M. Santadaria, F. A. Gianturco and R. Wester Investigating the electronic properties and structural features of MgH and of MgH- anions Phys. Rev. A 96 (2017) doi:10.1103/PhysRevA.96.042501 | |
| F. A. Gianturco, M. Satta, E. Yurtsever and R. Wester Formation of Anionic C, N-bearing Chains in the Interstellar Medium via Reactions of H- with HCxN for Odd-valued x from 1 to 7 Ap. J. 850 (2017) doi:10.3847/1538-4357/aa92ca | |
| F. Carelli, A. D. Boese, F. A. Gianturco and R. Wester Cold inelastic collisions of He(S-1) with the smallest astrophysical anion observed, CN-((1)Sigma(+)): an accurate quantum dynamical study. 875 (2017) doi:10.1088/1742-6596/875/11/102018 |
| 2016 | |
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| F. Carelli, J. Franz and F. A. Gianturco Dipole-driven dynamics for near-threshold electron/positron interactions with pyrimidinic DNA bases: a path to compound formations Mol. Phys. 114, 213-226 (2016) doi:10.1080/00268976.2015.1092609 | |
| I. Iskandarov, F. A. Gianturco, F. Carelli, E. Yurtsever and R. Wester Exploring a dynamical path for C2H- and NCO- formation in dark molecular clouds Eur. Phys. J. D 70 (2016) doi:10.1140/epjd/e2016-60639-2 | |
| F. Carelli and F. A. Gianturco Structure and dynamics of near-threshold leptons driven by dipolar interactions: an accurate computational study for the DNA purinic bases Eur. Phys. J. D 70 (2016) doi:10.1140/epjd/e2016-70106-9 | |
| E. Yurtsever, F. A. Gianturco and R. Wester Forming NCO- in Dense Molecular Clouds: Possible Gas-Phase Chemical Paths From Quantum Calculations J. Phys. Chem. A 120, 4693-4701 (2016) doi:10.1021/acs.jpca.5b10472 | |
| F. A. Gianturco, M. Satta, M. Mendolicchio, F. Palazzetti, A. Piserchia, V. Barone and R. Wester EXPLORING A CHEMICAL ROUTE FOR THE FORMATION OF STABLE ANIONS OF POLYYNES [CnH- (n=2, 4)] IN MOLECULAR CLOUDS Ap. J. 830 (2016) doi:10.3847/0004-637X/830/1/2 | |
| F. A. Gianturco, T. Grassi and R. Wester Modelling the role of electron attachment rates on column density ratios for CnH-/CnH (n=4; 6; 8) in dense molecular clouds J. Phys. B 49 (2016) doi:10.1088/0953-4075/49/20/204003 | |
| L. Gonzalez-Sanchez, F. A. Gianturco and R. Wester State-changing processes for ions in cold traps: LiH- molecules colliding with He as a buffer gas J. Phys. B 49 (2016) doi:10.1088/0953-4075/49/23/235201 |
| 2015 | |
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| D. Lopez-Duran, N. Aguirre, G. Delgado-Barrio, P. Villarreal, F. Gianturco and M. de Lara-Castells Potential Energy Surface and Bound States of the (X-4 Sigma)KRb-K Complex INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 115, 19-27 (2015) doi:10.1002/qua.24759 | |
| M. Satta, F. A. Gianturco, F. Carelli and R. Wester A QUANTUM STUDY OF THE CHEMICAL FORMATION OF CYANO ANIONS IN INNER CORES AND DIFFUSE REGIONS OF INTERSTELLAR MOLECULAR CLOUDS Ap. J. 799 (2015) doi:10.1088/0004-637X/799/2/228 | |
| M. Rodriguez-Cantano, T. Gonzalez-Lezana, P. Villarreal and F. A. Gianturco A configurational study of helium clusters doped with He*(-) and He2(*-) J. Chem. Phys. 142 (2015) doi:10.1063/1.4913958 | |
| F. Carelli, F. A. Gianturco, J. Franz and M. Satta A dipole-driven path for electron and positron attachments to gas-phase uracil and pyrimidine molecules: a quantum scattering analysis Eur. Phys. J. D 69 (2015) doi:10.1140/epjd/e2015-60096-5 | |
| D. Hauser, S. Lee, F. Carelli, S. Spieler, O. Lakhmanskaya, E. S. Endres, S. S. Kumar, F. Gianturco and R. Wester Rotational state-changing cold collisions of hydroxyl ions with helium NATURE PHYSICS 11, 467-470 (2015) doi:10.1038/NPHYS3326 | |
| D. Hauser, S. Lee, F. Carelli, S. Spieler, O. Lakhmanskaya, E. S. Endres, S. S. Kumar, F. Gianturco and R. Wester Rotational state-changing cold collisions of hydroxyl ions with helium (vol 11, pg 467, 2015) NATURE PHYSICS 11, 978 (2015) doi:10.1038/NPHYS3524 | |
| L. Gonzalez-Sanchez, F. Carelli, F. A. Gianturco and R. Wester Collisional state-changing of OH- rotations by interaction with Rb atoms in cold traps Chem. Phys. 462, 111-118 (2015) doi:10.1016/j.chemphys.2015.05.027 | |
| E. Carrascosa, M. Bawart, M. Stei, F. Linden, F. Carelli, J. Meyer, W. D. Geppert, F. A. Gianturco and R. Wester Nucleophilic substitution with two reactive centers: The CN- + CH3I case J. Chem. Phys. 143 (2015) doi:10.1063/1.4934993 | |
| L. Gonzalez-Sanchez, F. A. Gianturco, F. Carelli and R. Wester Computing rotational energy transfers of OD-/OH- in collisions with Rb: isotopic effects and inelastic rates at cold ion-trap conditions NEW JOURNAL OF PHYSICS 17 (2015) doi:10.1088/1367-2630/17/12/123003 | |
| P. Villarreal, R. Rodriguez-Cantano, T. Gonzalez-Lezana, R. Prosmiti, G. Delgado-Barrio and F. A. Gianturco Quantum Features of Anionic Species He*(-) and He-2*(-) in Small He-N Clusters J. Phys. Chem. A 119, 11574-11582 (2015) doi:10.1021/acs.jpca.5b08470 | |
| P. Villarreal, R. Rodriguez-Cantano, T. Gonzalez-Lezana, R. Prosmiti, G. Delgado-Barrio and F. A. Gianturco Variational and Path Integral Monte Carlo calculations on Helium Clusters Doped with Metastable Anions He*(-) and He-2*(-) 635 (2015) doi:10.1088/1742-6596/635/7/072009 | |
| S. Bovino, T. Grassi and F. A. Gianturco CH+ Destruction by Reaction with H: Computing Quantum Rates To Model Different Molecular Regions in the Interstellar Medium J. Phys. Chem. A 119, 11973-11982 (2015) doi:10.1021/acs.jpca.5b02785 |
| 2014 | |
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| A. G. Sanz, M. C. Fuss, F. Blanco, Z. Masin, J. D. Gorfinkiel, F. Carelli, F. Sebastianelli, F. A. Gianturco and G. Garcia Electron scattering cross section calculations for polar molecules over a broad energy range APPLIED RADIATION AND ISOTOPES 83, 57-67 (2014) doi:10.1016/j.apradiso.2013.01.031 | |
| A. G. Sanz, M. C. Fuss, F. Blanco, F. Carelli, F. Sebastianelli, F. A. Gianturco and G. Garcia Electron scattering cross sections from anthracene over a broad energy range (0.00001-10,000 eV) APPLIED RADIATION AND ISOTOPES 83, 68-76 (2014) doi:10.1016/j.apradiso.2012.12.015 | |
| F. Carelli, M. Satta, F. Sebastianelli and F. A. Gianturco Comment on `Dynamics of formation of anthracene anions in molecular clouds and protoplanetary atmospheres ́Reply NEW JOURNAL OF PHYSICS 16 (2014) doi:10.1088/1367-2630/16/2/028002 | |
| T. Grassi, S. Bovino, D. R. G. Schleicher, J. Prieto, D. Seifried, E. Simoncini and F. A. Gianturco KROME - a package to embed chemistry in astrophysical simulations MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY 439, 2386-2419 (2014) doi:10.1093/mnras/stu114 | |
| F. Carelli, F. A. Gianturco, M. Satta and F. Sebastianelli Attaching electrons to a 3-ring acene: Structures and dynamics of anions in gas-phase anthracene Int. J. Mass. Spectrom. 365, 377-383 (2014) doi:10.1016/j.ijms.2014.03.014 | |
| J. Franz, F. A. Gianturco and I. Baccarelli Low-energy positron scattering from gas-phase uracil Eur. Phys. J. D 68 (2014) doi:10.1140/epjd/e2014-40796-0 | |
| F. Carelli, F. A. Gianturco, R. Wester and M. Satta Formation of cyanopolyyne anions in the interstellar medium: The possible role of permanent dipoles J. Chem. Phys. 141 (2014) doi:10.1063/1.4891300 | |
| F. A. Gianturco Learning New Things Often and All along the Way: A Personal Account of 50 Years in Science J. Phys. Chem. A 118, 6301-6303 (2014) doi:10.1021/jp504455q | |
| R. Rodriguez-Cantano, T. Gonzalez-Lezana, P. Villarreal, D. Lopez-Duran, F. A. Gianturco and G. Delgado-Barrio Path Integral Monte Carlo Calculations of Calcium-Doped He-4 Clusters INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 114, 1318-1326 (2014) doi:10.1002/qua.24622 | |
| J. Franz and F. A. Gianturco Low-energy positron scattering from DNA nucleobases: the effects from permanent dipoles Eur. Phys. J. D 68 (2014) doi:10.1140/epjd/e2014-50072-0 |
| 2013 | |
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| A. Garcia-Sanz, F. Carelli, F. Sebastianelli, F. A. Gianturco and G. Garcia Dynamics of formation of anthracene anions in molecular clouds and protoplanetary atmospheres NEW JOURNAL OF PHYSICS 15 (2013) doi:10.1088/1367-2630/15/1/013018 | |
| R. Curik and F. A. Gianturco Indirect dissociative recombination of LiHe+ ions driven by vibrational Feshbach resonances Phys. Rev. A 87 (2013) doi:10.1103/PhysRevA.87.012705 | |
| F. Carelli, T. Grassi and F. A. Gianturco Electron attachment rates for PAH anions in the ISM and dark molecular clouds: dependence on their chemical properties ASTRONOMY & ASTROPHYSICS 549 (2013) doi:10.1051/0004-6361/201219990 | |
| F. Carelli, T. Grassi, F. Sebastianelli and F. A. Gianturco Electron-attachment rates for carbon-rich molecules in protoplanetary atmospheres: the role of chemical differences MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY 428, 1181-1184 (2013) doi:10.1093/mnras/sts100 | |
| M. Satta, T. Grassi and F. A. Gianturco Carbon cations and silicon atoms in the ISM: modelling their charge exchange reaction MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY 429, 269-274 (2013) doi:10.1093/mnras/sts334 | |
| M. Satta, T. Grassi and F. A. Gianturco Carbon cations and silicon atoms in the ISM: modelling their charge-exchange reaction (vol 429, pg 269, 2013) MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY 431, 1004 (2013) doi:10.1093/mnras/stt204 | |
| T. Grassi, S. Bovino, D. Schleicher and F. A. Gianturco Chemical complexity in astrophysical simulations: optimization and reduction techniques MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY 431, 1659-1668 (2013) doi:10.1093/mnras/stt284 | |
| R. Carey, R. R. Lucchese and F. A. Gianturco Electron scattering from gas phase cis-diamminedichloroplatinum(II): Quantum analysis of resonance dynamics J. Chem. Phys. 138 (2013) doi:10.1063/1.4807083 | |
| I. Baccarelli, F. Sebastianelli, B. M. Nestmann and F. A. Gianturco Forming metastable carbon-rich anions in planetary atmospheres: the case of diacetylene Eur. Phys. J. D 67 (2013) doi:10.1140/epjd/e2013-30741-2 | |
| R. Rodriguez-Cantano, R. Perez de Tudela, D. Lopez-Duran, T. Gonzalez-Lezana, F. A. Gianturco, G. Delgado-Barrio and P. Villarreal Quantum rotation of Rb-2((3)Sigma(+)(u)) attached to He-N droplets: a path-integral Monte Carlo study Eur. Phys. J. D 67 (2013) doi:10.1140/epjd/e2013-40139-9 | |
| F. Carelli, M. Satta, T. Grassi and F. A. Gianturco CARBON-RICH MOLECULAR CHAINS IN PROTOPLANETARY AND PLANETARY ATMOSPHERES: QUANTUM MECHANISMS AND ELECTRON ATTACHMENT RATES FOR ANION FORMATION Ap. J. 774 (2013) doi:10.1088/0004-637X/774/2/97 | |
| M. Satta, M. Marquez-Mijares, E. Yurtsever, S. Bovino and F. A. Gianturco Mg+(S-2) and Mg+(P-2) in reaction with H-2((1)Sigma(+)(g)): A description of the energy surfaces explaining the mechanisms Int. J. Mass. Spectrom. 351, 47-55 (2013) doi:10.1016/j.ijms.2013.03.019 | |
| J. Franz and F. A. Gianturco Low-energy positron scattering from gas-phase pyrimidine: A quantum treatment of the dynamics and a comparison with experiments Phys. Rev. A 88 (2013) doi:10.1103/PhysRevA.88.042711 | |
| F. Carelli, M. Satta and F. A. Gianturco Resonant electron attachment to polar aromatic molecules: consequences for their chemistry in the interstellar medium Eur. Phys. J. D 67 (2013) doi:10.1140/epjd/e2013-40422-9 | |
| M. Satta, T. Grassi, F. A. Gianturco, S. A. Yakovleva and A. K. Belyaev Reducing Si population in the ISM by charge exchange collisions with He+: a quantum modelling of the process MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY 436, 2722-2733 (2013) doi:10.1093/mnras/stt1771 | |
| J. Franz and F. A. Gianturco Low-energy positron scattering from gas-phase tetrahydrofuran: A quantum treatment of the dynamics and a comparison with experiments J. Chem. Phys. 139 (2013) doi:10.1063/1.4832417 | |
| F. Carelli and F. A. Gianturco Electron angular distributions and attachment rates in o-Benzyne and Phenyl aromatic molecules: the effect of the permanent dipoles Eur. Phys. J. D 67 (2013) doi:10.1140/epjd/e2013-40434-5 |
| 2012 | |
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| M. Tacconi, S. Bovino and F. A. Gianturco Direct and inverse reactions of LiH+ with He(S-1) from quantum calculations: mechanisms and rates Phys. Chem. Chem. Phys. 14, 637-645 (2012) doi:10.1039/c1cp22315a | |
| F. Sebastianelli and F. A. Gianturco Metastable anions of polyynes: Dynamics of fragmentation/stabilization in planetary atmospheres after electron attachment Eur. Phys. J. D 66 (2012) doi:10.1140/epjd/e2011-20619-8 | |
| D. Lopez-Duran, R. Rodriguez-Cantano, T. Gonzalez-Lezana, G. Delgado-Barrio, P. Villarreal, E. Yurtsever and F. A. Gianturco Weakly bound finite systems: (He-4)(N)-Rb-2((3)Sigma(u)), clustering structures from a quantum Monte Carlo approach JOURNAL OF PHYSICS-CONDENSED MATTER 24 (2012) doi:10.1088/0953-8984/24/10/104014 | |
| R. Rodriguez-Cantano, D. Lopez-Duran, T. Gonzalez-Lezana, G. Delgado-Barrio, P. Villarreal, E. Yurtsever and F. A. Gianturco Spin-Polarized Rb-2 Interacting with Bosonic He Atoms: Potential Energy Surface and Quantum Structures of Small Clusters J. Phys. Chem. A 116, 2394-2404 (2012) doi:10.1021/jp3004932 | |
| S. Bovino, M. Tacconi and F. A. Gianturco PHOTON-INDUCED EVOLUTIONARY RATES OF LiHe+ ((1)Sigma(+)) IN EARLY UNIVERSE FROM ACCURATE QUANTUM COMPUTATIONS (vol 740, pg 101,2011) Ap. J. 748 (2012) doi:10.1088/0004-637X/748/2/150 | |
| D. Caruso, M. Tacconi, F. A. Gianturco and E. Yurtsever Quenching vibrations by collisions in cold traps: A quantum study for MgH+ (X-1 Sigma(+)) with He-4(S-1) JOURNAL OF CHEMICAL SCIENCES 124, 93-97 (2012) doi:10.1007/s12039-011-0190-4 | |
| A. K. Belyaev, S. A. Yakovleva, M. Tacconi and F. A. Gianturco Resonances in Ca+ + Rb nonadiabatic collisions at ultralow energies Phys. Rev. A 85 (2012) doi:10.1103/PhysRevA.85.042716 | |
| F.Sebastianelli, F. Carelli and F. A. Gianturco Forming (NCCN)(-) by quantum scattering: A modeling for Titanś atmosphere Chem. Phys. 398, 199-205 (2012) doi:10.1016/j.chemphys.2011.08.004 | |
| F. Marinetti and F. A. Gianturco LiH-((2)Sigma(+)) attached to small clusters of He-4: A stochastic analysis Chem. Phys. 399, 205-212 (2012) doi:10.1016/j.chemphys.2011.07.003 | |
| F. Carelli and F. A. Gianturco Polycyclic aromatic hydrocarbon negative ions in interstellar clouds: a quantum study on coronene metastable anions MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY 422, 3643-3648 (2012) doi:10.1111/j.1365-2966.2012.20876.x | |
| F. Carelli and F. A. Gianturco Resonant dynamics of gas-phase electron-driven reactions: The coronene molecule as a prototype in planetary atmospheres and interstellar clouds COMPUTATIONAL AND THEORETICAL CHEMISTRY 990, 67-74 (2012) doi:10.1016/j.comptc.2011.12.001 | |
| R. Rodriguez-Cantano, D. Lopez-Duran, R. Perez de Tudela, T. Gonzalez-Lezana, G. Delgado-Barrio, P. Villarreal and F. A. Gianturco Helium aggregates doped with alkali dimer impurities: A finite temperature study of He-4(N)-Rb-2((3)Sigma(+)(u)) complexes COMPUTATIONAL AND THEORETICAL CHEMISTRY 990, 106-111 (2012) doi:10.1016/j.comptc.2012.03.018 | |
| S. Bovino, R. Curik, D. Galli, M. Tacconi and F. A. Gianturco LiHe+ IN THE EARLY UNIVERSE: A FULL ASSESSMENT OF ITS REACTION NETWORK AND FINAL ABUNDANCES Ap. J. 752 (2012) doi:10.1088/0004-637X/752/1/19 | |
| D. David Lopez-Duran, T. Gonzalez-Lezana, G. Delgado-Barrio, P. Villarreal and F. A. Gianturco Comment on ``Weakly bound states of the He-He-Ca triatomic system” Phys. Rev. A 86 (2012) doi:10.1103/PhysRevA.86.016501 | |
| D. Lopez-Duran, R. Rodriguez-Cantano, T. Gonzalez-Lezana, G. Delgado-Barrio, P. Villarreal and F. A. Gianturco Binding energies and structures of Ca-He-2 weakly bound triatomic complexes Phys. Rev. A 86 (2012) doi:10.1103/PhysRevA.86.022501 | |
| D. Lopez-Duran, R. Rodriguez-Cantano, T. Gonzalez-Lezana, G. Delgado-Barrio, P. Villarreal and F. A. Gianturco Binding weakly interacting partners: a study of Ca-He-2 and its isotopomers Eur. Phys. J. D 66 (2012) doi:10.1140/epjd/e2012-30202-6 | |
| T. Grassi, S. Bovino, F. A. Gianturco, P. Baiocchi and E. Merlin Complexity reduction of astrochemical networks MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY 425, 1332-1340 (2012) doi:10.1111/j.1365-2966.2012.21537.x | |
| A. G. Sanz, M. C. Fuss, F. Blanco, F. Sebastianelli, F. A. Gianturco and G. Garcia Electron scattering cross sections from HCN over a broad energy range (0.1-10 000 eV): Influence of the permanent dipole moment on the scattering process J. Chem. Phys. 137 (2012) doi:10.1063/1.4754661 | |
| S. Bovino, F. A. Gianturco and M. Tacconi Chemical destruction of rotationally ``hot” HeH+: Quantum cross sections and mechanisms of its reaction with H Chem. Phys. Lett. 554, 47-52 (2012) doi:10.1016/j.cplett.2012.10.027 | |
| R. Perez de Tudela, D. Lopez-Duran, M. P. de Lara-Castells, R. Prosmiti, O. Roncero, G. Delgado-Barrio, F. A. Gianturco, J. Jellinek and P. Villarreal A Quantum Chemistry Approach to Energies, Structures, and Spectroscopy of Doped Helium Clusters 1504, 240-253 (2012) doi:10.1063/1.4771719 |
| 2011 | |
|---|---|
| F. Marinetti and F. A. Gianturco Water as a solute: competitive shell formation in (He,Ne) mixed microdroplets Phys. Chem. Chem. Phys. 13, 2136-2144 (2011) doi:10.1039/c0cp01342k | |
| S. Bovino, P. Zhang, F. A. Gianturco, A. Dalgarno and V. Kharchenko Energy transfer in O collisions with He isotopes and Helium escape from Mars GEOPHYSICAL RESEARCH LETTERS 38 (2011) doi:10.1029/2010GL045763 | |
| S. Bovino, M. Tacconi, F. A. Gianturco, D. Galli and F. Palla ON THE RELATIVE ABUNDANCE OF LiH AND LiH+ MOLECULES IN THE EARLY UNIVERSE: NEW RESULTS FROM QUANTUM REACTIONS Ap. J. 731 (2011) doi:10.1088/0004-637X/731/2/107 | |
| M. Tacconi, S. Bovino and F. A. Gianturco Testing the lithium chemistry for early universe models with a quantum reactive method RENDICONTI LINCEI-SCIENZE FISICHE E NATURALI 22, 69-80 (2011) doi:10.1007/s12210-011-0114-8 | |
| R. Perez de Tudela, D. Lopez-Duran, T. Gonzalez-Lezana, G. Delgado-Barrio, P. Villarreal, F. A. Gianturco and E. Yurtsever Quantum Features of a Barely Bound Molecular Dopant: Cs-2((3)Sigma(u)) in Bosonic Helium Droplets of Variable Size J. Phys. Chem. A 115, 6892-6902 (2011) doi:10.1021/jp111825n | |
| M. Tacconi, F. A. Gianturco, E. Yurtsever and D. Caruso Cooling and quenching of (MgH+)-Mg-24(X-1 Sigma(+)) by He-4(S-1) in a Coulomb trap: A quantum study of the dynamics Phys. Rev. A 84 (2011) doi:10.1103/PhysRevA.84.013412 | |
| S. Bovino, M. Tacconi and F. A. Gianturco Cold Chemistry with Ionic Partners: Quantum Features of HeH+((1)Sigma) with H(S-1) at Ultralow Energies J. Phys. Chem. A 115, 8197-8203 (2011) doi:10.1021/jp203113e | |
| F. Carelli, F. Sebastianelli, M. Satta and F. A. Gianturco Gas-phase route to polycyclic aromatic hydrocarbon formation in protoplanetary atmospheres: role of stabilized benzyne anions MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY 415, 425-430 (2011) doi:10.1111/j.1365-2966.2011.18711.x | |
| S. Bovino, M. Tacconi, F. A. Gianturco and D. Galli Ion chemistry in the early universe Revisiting the role of HeH+ with new quantum calculations ASTRONOMY & ASTROPHYSICS 529 (2011) doi:10.1051/0004-6361/201116740 | |
| S. Bovino, M. Tacconi and F. A. Gianturco LiH destruction by protons: a comparison of quantum models for an important astrochemical process PHYSICA SCRIPTA 84 (2011) doi:10.1088/0031-8949/84/02/028103 | |
| M. Tacconi, F. A. Gianturco and A. K. Belyaev Computing charge-exchange cross sections for Ca+ collisions with Rb at low and ultralow energies Phys. Chem. Chem. Phys. 13, 19156-19164 (2011) doi:10.1039/c1cp20916g | |
| F. Sebastianelli, F. Carelli and F. A. Gianturco Modeling Chemical Evolution in a Cold Molecular Plasma: Quantum Dynamics of CF2- Intermediates after Electron Attachment J. Phys. Chem. A 115, 11531-11543 (2011) doi:10.1021/jp206618x | |
| S. Bovino, M. Tacconi and F. A. Gianturco PHOTON-INDUCED EVOLUTIONARY RATES OF LiHe+ ((1)Sigma(+)) IN EARLY UNIVERSE FROM ACCURATE QUANTUM COMPUTATIONS Ap. J. 740 (2011) doi:10.1088/0004-637X/740/2/101 | |
| D. Caruso, M. Tacconi, E. Yurtsever, S. Bovino and F. A. Gianturco Quenching vibrations of cesium dimers by He at low and ultralow temperatures: quantum dynamical calculations Eur. Phys. J. D 65, 167-175 (2011) doi:10.1140/epjd/e2011-20029-0 | |
| I. Baccarelli, I. Bald, F. A. Gianturco, E. Illenberger and J. Kopyra Electron-induced damage of DNA and its components: Experiments and theoretical models PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS 508, 1-44 (2011) doi:10.1016/j.physrep.2011.06.004 | |
| F. Carelli and F. A. Gianturco ON THE RELATIVE "TRANSPARENCY” OF GAS-PHASE CORONENE MOLECULES TO LOW-ENERGY ELECTRONS: EFFECTS ON THE INTERSTELLAR MEDIUM Ap. J. 743 (2011) doi:10.1088/0004-637X/743/2/151 |
| 2010 | |
|---|---|
| S. Bovino, T. Stoecklin and F. A. Gianturco THE IONIC PATHWAYS OF LITHIUM CHEMISTRY IN THE EARLY UNIVERSE: QUANTUM CALCULATIONS FOR LiH+ REACTING WITH H Ap. J. 708, 1560-1565 (2010) doi:10.1088/0004-637X/708/2/1560 | |
| S. Orlandini, E. Coccia, I. Baccarelli, F. A. Gianturco, E. Garrido, T. Gonzalez-Lezana, G. Delgado-Barrio and P. Villarreal Binding He atoms to hydrogen moieties: quantum features from ultraweak interactions Mol. Phys. 108, 57-72 (2010) doi:10.1080/00268970903496660 | |
| E. Coccia and F. A. Gianturco Attachment Energetics of Quantum Dopants in a Weakly Interacting Quantum Solvent: H-1, H-2 and H-3 in Small He-4 Clusters J. Phys. Chem. A 114, 3221-3228 (2010) doi:10.1021/jp909403t | |
| F. Carelli, F. Sebastianelli, I. Baccarelli and F. A. Gianturco ELECTRON-DRIVEN REACTIONS IN PROTO-PLANETARY ATMOSPHERES: METASTABLE ANIONS OF GASEOUS o-BENZYNE Ap. J. 712, 445-452 (2010) doi:10.1088/0004-637X/712/1/445 | |
| S. Bovino, T. Stoecklin and F. A. Gianturco THE IONIC PATHWAYS OF LITHIUM CHEMISTRY IN THE EARLY UNIVERSE: QUANTUM CALCULATIONS FOR LiH+ REACTING WITH H (vol 708, pg 1560, 2010) Ap. J. 713, 711 (2010) doi:10.1088/0004-637X/713/1/711 | |
| D. Caruso, M. Tacconi, E. Yurtsever and F. A. Gianturco Quenching of internal rotations versus collisional cooling at ultralow energies for weakly interacting partners: Cs-2((3)Sigma(+)(u)) with He-3,He-4 Phys. Rev. A 81 (2010) doi:10.1103/PhysRevA.81.042710 | |
| F. Sebastianelli and F. A. Gianturco Stabilizing dicyanoacetylene anions in planetary atmospheres: quantum dynamics of its transient negative ions Eur. Phys. J. D 59, 389-398 (2010) doi:10.1140/epjd/e2010-00170-0 | |
| F. Marinetti, E. Yurtsever and F. A. Gianturco HCHO in a Cold, Quantum Solvent: Size and Shape of Its "Bubbles” in He-4 Droplets from Stochastic Simulations J. Phys. Chem. A 114, 9725-9732 (2010) doi:10.1021/jp1018857 | |
| I. Baccarelli, F. A. Gianturco, E. Scifoni, A. V. Solovýov and E. Surdutovich Molecular level assessments of radiation biodamage Eur. Phys. J. D 60, 1-10 (2010) doi:10.1140/epjd/e2010-00216-3 | |
| C. Panosetti, I. Baccarelli, F. Sebastianelli and F. A. Gianturco Modelling fragmentations of aminoacids after resonant electron attachment: quantum evidence of possible direct -OH detachment Eur. Phys. J. D 60, 21-30 (2010) doi:10.1140/epjd/e2010-00168-6 | |
| S. Bovino, M. Tacconi, F. A. Gianturco and T. Stoecklin IS H+ AN EFFICIENT DESTROYER OF LiH MOLECULES? A QUANTUM INVESTIGATION AT EARLY UNIVERSE CONDITIONS Ap. J. 724, 126-130 (2010) doi:10.1088/0004-637X/724/1/126 |
| 2009 | |
|---|---|
| T. P. M. Goumans, F. A. Gianturco, F. Sebastianelli, I. Baccarelli and J. L. Rivail Dissociative Electron Attachment to Formamide: Direct and Indirect Pathways from Resonant Intermediates JOURNAL OF CHEMICAL THEORY AND COMPUTATION 5, 217-221 (2009) doi:10.1021/ct800379h | |
| I. Baccarelli, F. Sebastianelli, F. A. Gianturco and N. Sanna Modelling dissociative dynamics of biosystems after metastable electron attachment: the sugar backbones Eur. Phys. J. D 51, 131-136 (2009) doi:10.1140/epjd/e2008-00104-5 | |
| M. Wernli, D. Caruso, E. Bodo and F. A. Gianturco Computing a Three-Dimensional Electronic Energy Manifold for the LiH plus H (sic) Li + H-2 Chemical Reaction J. Phys. Chem. A 113, 1121-1128 (2009) doi:10.1021/jp809163g | |
| M. Wernli, E. Scifoni, E. Bodo and F. A. Gianturco A quantum modeling of the chemistry of LiH+ with He from ab initio calculations: Ionic reactions in He nanodroplets Int. J. Mass. Spectrom. 280, 57-64 (2009) doi:10.1016/j.ijms.2008.07.019 | |
| E. Coccia, E. Bodo and F. A. Gianturco Size-dependent solvation of p-H-2 in He-4 clusters: A quantum Monte Carlo analysis J. Chem. Phys. 130 (2009) doi:10.1063/1.3078705 | |
| S. Orlandini, I. Baccarelli and F. A. Gianturco Variational calculations of structures and energetics in very floppy trimers: A new computational implementation COMPUTER PHYSICS COMMUNICATIONS 180, 384-391 (2009) doi:10.1016/j.cpc.2008.10.014 | |
| M. Marquez-Mijares, R. Perez de Tudela, T. Gonzalez-Lezana, O. Roncero, S. Miret-Artes, G. Delgado-Barrio, P. Villarreal, I. Baccarelli, F. A. Gianturco and J. Rubayo-Soneira A theoretical investigation on the spectrum of the Ar trimer for high rotational excitations J. Chem. Phys. 130 (2009) doi:10.1063/1.3115100 | |
| A. Ponzi, F. Marinetti and F. A. Gianturco Structuring molecular hydrogen around ionic dopants: Li+ cations in small pH(2) clusters Phys. Chem. Chem. Phys. 11, 3868-3874 (2009) doi:10.1039/b820190k | |
| S. Bovino, M. Wernli and F. A. Gianturco FAST LiH DESTRUCTION IN REACTION WITH H: QUANTUM CALCULATIONS AND ASTROPHYSICAL CONSEQUENCES Ap. J. 699, 383-387 (2009) doi:10.1088/0004-637X/699/1/383 | |
| F. Sebastianelli, F. A. Gianturco, T. Stoecklin and I. Baccarelli Scattering of electrons by gaseous CS((1)Sigma): The role of short-range forces on the very-low energy (2)Pi resonance Chem. Phys. Lett. 476, 182-185 (2009) doi:10.1016/j.cplett.2009.06.044 | |
| M. Tacconi and F. A. Gianturco Exchanging the ionic partner in a linear Paul trap: the MgH+((XI)-I-1 (+)) pound ion with neutral Rb(S-2) Eur. Phys. J. D 54, 31-41 (2009) doi:10.1140/epjd/e2009-00162-1 | |
| J. Franz, I. Baccarelli, S. Caprasecca and F. A. Gianturco Computed vibrational excitation of CF4 by low-energy electrons and positrons: Comparing calculations and experiments Phys. Rev. A 80 (2009) doi:10.1103/PhysRevA.80.012709 | |
| F. A. Gianturco and M. Tacconi Concluding remarks: achievements and challenges in cold and ultracold molecules Faraday Disc. 142, 463-477 (2009) doi:10.1039/b910178k | |
| M. Tacconi and F. A. Gianturco Translational cooling versus vibrational quenching in ultracold OH--Rb collisions: A quantum assessment J. Chem. Phys. 131 (2009) doi:10.1063/1.3192101 | |
| D. Lopez-Duran, M. Tacconi and F. A. Gianturco LiH-((XI)-I-2 (+))+He-3 pound,He-4 rotational quenching at ultralow energies: spin-flip and isotopic effects from quantum dynamics on an ionic system Eur. Phys. J. D 55, 601-611 (2009) doi:10.1140/epjd/e2009-00281-7 | |
| F. A. Gianturco, F. Sebastianelli, R. R. Lucchese, I. Baccarelli and N. Sanna Ring-breaking electron attachment to uracil: Following bond dissociations via evolving resonances (vol 128, 174302, 2008) J. Chem. Phys. 131 (2009) doi:10.1063/1.3274177 | |
| R. Prosmiti, G. Delgado-Barrio, P. Villarreal, E. Yurtsever, E. Coccia and F. A. Gianturco Structuring a Quantum Solvent around a Weakly Bound Dopant: The He-CS2((3)Sigma u) Complex J. Phys. Chem. A 113, 14718-14729 (2009) doi:10.1021/jp9048583 |
| 2008 | |
|---|---|
| M. Tacconi and F. A. Gianturco Molecular ions in ultracold atomic gases: computed electronic interactions for MgH+(X-1 Sigma(+)) with Rb Eur. Phys. J. D 46, 443-451 (2008) doi:10.1140/epjd/e2007-00315-2 | |
| E. Coccia, F. Marinetti, E. Bodo and F. A. Gianturco Anionic microsolvation in helium droplets: OH-(He)(N) structures from classical and quantum calculations J. Chem. Phys. 128 (2008) doi:10.1063/1.2842082 | |
| E. Coccia, E. Bodo and F. A. Gianturco Nanoscopic phase changes in doped He-4 droplets EPL 82 (2008) doi:10.1209/0295-5075/82/23001 | |
| S. Bovino, E. Bodo and F. A. Gianturco Ultralow-energy vibrational quenching in ionic collisions: Isotope effects in Li++D-2 encounters Phys. Rev. A 77 (2008) doi:10.1103/PhysRevA.77.042716 | |
| J. Franz, F. A. Gianturco, K. L. Baluja, J. Tennyson, R. Carey, R. Montuoro, R. R. Lucchese, T. Stoecklin, P. Nicholas and T. L. Gibson Correlation-polarization effects in electron/positron scattering from acetylene: A comparison of computational models NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS 266, 425-434 (2008) doi:10.1016/j.nimb.2007.12.019 | |
| S. Orlandini, I. Baccarelli and F. A. Gianturco Searching for many-body effects and Efimov states in very weakly bound triatomics: HeNeH- and HeNeH Mol. Phys. 106, 573-586 (2008) doi:10.1080/00268970801939001 | |
| F. A. Gianturco, F. Sebastianelli, R. R. Lucchese, I. Baccarelli and N. Sanna Ring-breaking electron attachment to uracil: Following bond dissociations via evolving resonances J. Chem. Phys. 128 (2008) doi:10.1063/1.2913169 | |
| L. Gonzalez-Sanchez, E. Bodo, E. Yurtsever and F. A. Gianturco Quenching efficiency of "hot” polar molecules by He buffer gas at ultralow energies: quantum results for MgH and LiH rotations Eur. Phys. J. D 48, 75-82 (2008) doi:10.1140/epjd/e2008-00072-8 | |
| S. Bovino, E. Bodo, E. Yurtsever and F. A. Gianturco Vibrational cooling of spin-stretched dimer states by He buffer gas: Quantum calculations for Li-2(a (3)Sigma(+)(u)) at ultralow energies J. Chem. Phys. 128 (2008) doi:10.1063/1.2933405 | |
| E. Coccia, F. Marinetti, E. Bodo and F. A. Gianturco Chemical solutions in a quantum solvent: Anionic electrolytes in He-4 nanodroplets CHEMPHYSCHEM 9, 1323-1330 (2008) doi:10.1002/cphc.200800132 | |
| I. Baccarelli, F. A. Gianturco, A. Grandi and N. Sanna Metastable anion fragmentations after resonant attachment: Deoxyribosic structures from quantum electron dynamics INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 108, 1878-1887 (2008) doi:10.1002/qua.21681 | |
| R. Carey, R. R. Lucchese and F. A. Gianturco Positron scattering from C-20 Phys. Rev. A 78 (2008) doi:10.1103/PhysRevA.78.012706 | |
| L. Gonzalez-Sanchez, M. Tacconi, E. Bodo and F. A. Gianturco Ionic interactions and collision dynamics in cold traps: rotational quenching of OH-((1)Sigma(+)) by Rb(S-2) Eur. Phys. J. D 49, 85-92 (2008) doi:10.1140/epjd/e2008-00148-5 | |
| F. A. Gianturco Quenching of internally "hot"H(2) and N(2) gases by collisions with ultracold electrons: a computational "experiment" PHYSICA SCRIPTA 78 (2008) doi:10.1088/0031-8949/78/05/058102 | |
| F. Carelli, F. Sebastianelli, I. Baccarelli and F. A. Gianturco Following electron attachment to CS ((1)Sigma): Quantum scattering calculations of the lowest resonant state Int. J. Mass. Spectrom. 277, 155-161 (2008) doi:10.1016/j.ijms.2008.07.015 | |
| D. Lopez-Duran, E. Bodo and F. A. Gianturco ASPIN: An all spin scattering code for atom-molecule rovibrationally inelastic cross sections COMPUTER PHYSICS COMMUNICATIONS 179, 821-838 (2008) doi:10.1016/j.cpc.2008.07.017 | |
| F. Marinetti, E. Bodo, F. A. Gianturco and E. Yurtsever Energetics and Structures of Charged Helium Clusters: Comparing Stabilities of Dimer and Trimer Cationic Cores CHEMPHYSCHEM 9, 2618-2624 (2008) doi:10.1002/cphc.200800457 |
| 2007 | |
|---|---|
| I. Baccarelli, F. A. Gianturco, A. Grandi, R. R. Lucchese and N. Sanna Electron-driven molecular processes induced in biological systems by electromagnetic and other ionizing sources 52, 189+ (2007) doi:10.1016/S0065-3276(06)52009-X | |
| F. Marinetti, E. Bodo and F. A. Gianturco Microsolvation of an ionic dopant in small He-4 clusters: OH+((3)Sigma)(He-4)(N) via genetic algorithm optimizations CHEMPHYSCHEM 8, 93-100 (2007) doi:10.1002/cphc.200600440 | |
| M. Tacconi, E. Bodo and F. A. Gianturco Sympathetic cooling of NH(X-3 Sigma(-)) molecules by Rb and Cs atoms at ultralow energies Phys. Rev. A 75 (2007) doi:10.1103/PhysRevA.75.012708 | |
| F. A. Gianturco and T. Stoecklin Electron scattering from gaseous OCS ((1)Sigma): Comparing computed angular distributions and elastic cross-sections with experiments Chem. Phys. 332, 145-151 (2007) doi:10.1016/j.chemphys.2006.09.020 | |
| E. Coccia, E. Bodo, F. Marinetti, F. A. Gianturco, E. Yildrim, M. Yurtsever and E. Yurtsever Bosonic helium droplets with cationic impurities: Onset of electrostriction and snowball effects from quantum calculations J. Chem. Phys. 126 (2007) doi:10.1063/1.2712437 | |
| E. Bodo and F. A. Gianturco Quenching of vibrationally excited molecules by ultracold collisions with ions: Controlling the scattering via changes of internal states EPL 77 (2007) doi:10.1209/0295-5075/77/33001 | |
| F. A. Gianturco and T. Stoecklin Low-energy electron scattering from gaseous CS2: angular distributions and effect of exchange forces Eur. Phys. J. D 42, 85-91 (2007) doi:10.1140/epjd/e2007-00032-x | |
| M. Tacconi, E. Bodo and F. A. Gianturco Interaction of NH(X-3 Sigma(-)) with Rb and Cs atoms: similarities and differences from an highly correlated ab initio study THEORETICAL CHEMISTRY ACCOUNTS 117, 649-662 (2007) doi:10.1007/s00214-006-0193-2 | |
| I. Baccarelli, F. A. Gianturco, A. Grandi, N. Sanna, R. R. Lucchese, I. Bald, J. Kopyra and E. Illenberger Selective bond breaking in beta-D-ribose by gas-phase electron attachment around 8 eV JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 129, 6269-6277 (2007) doi:10.1021/ja070542h | |
| E. Yurtsever, E. Yildirim, M. Yurtsever, E. Bodo and F. A. Gianturco Solvation of K+ in helium droplets Eur. Phys. J. D 43, 105-108 (2007) doi:10.1140/epjd/e2007-00068-x | |
| F. A. Gianturco and K. Willner Ramsauer-Townsend effect for electron scattering from gaseous CF4 molecules Phys. Rev. A 75 (2007) doi:10.1103/PhysRevA.75.062714 | |
| F. Marinetti, E. Coccia, E. Bodo, F. A. Gianturco, E. Yurtsever, M. Yurtsever and E. Yildirim Bosonic helium clusters doped by alkali metal cations: interaction forces and analysis of their most stable structures THEORETICAL CHEMISTRY ACCOUNTS 118, 53-65 (2007) doi:10.1007/s00214-006-0240-z | |
| L. Gonzalez-Sanchez, E. Bodo and F. A. Gianturco Quenching of molecular ions by He buffer loading at ultralow energies: rotational cooling of OH+((3)Sigma(-)) from quantum calculations Eur. Phys. J. D 44, 65-72 (2007) doi:10.1140/epjd/e2007-00156-y | |
| P. Villarreal, M. P. De lara-Castells, R. Prosmiti, G. Delgado-Barrio, D. Lopez-Duran, F. A. Gianturco and J. Jellinek Spectral simulations of polar diatomic molecules immersed in He clusters: application to the ICl (X) molecule PHYSICA SCRIPTA 76, C96-C103 (2007) doi:10.1088/0031-8949/76/3/N15 | |
| E. Bodo, E. Coccia, D. Lopez-Duran and F. A. Gianturco Ionic dopants in He droplets: cluster energies from a variational and diffusion Monte Carlo approach PHYSICA SCRIPTA 76, C104-C110 (2007) doi:10.1088/0031-8949/76/3/N16 | |
| M. Tacconi, L. Gonzalez-Sanchez, E. Bodo and F. A. Gianturco Collisions of NH((3)Sigma(-)) with Rb and Cs at ultralow energies: A quantum study of rotational cooling efficiency Phys. Rev. A 76 (2007) doi:10.1103/PhysRevA.76.032702 | |
| M. P. de Lara-Castells, R. Prosmiti, D. Lopez-Duran, G. Delgado-Barrio, P. Villarreal, F. Gianturco and J. Jellinek Doped helium clusters analyzed through quantum chemistry methods INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 107, 2902-2921 (2007) doi:10.1002/qua.21446 | |
| I. Baccarelli, F. A. Gianturco, T. Gonzalez-Lezana, G. Delgado-Barrio, S. Miret-Artes and P. Villarreal Vibrational and rotational bound states in floppy triatomic systems: The distributed Gaussian functions approach PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS 452, 1-32 (2007) doi:10.1016/j.physrep.2007.07.002 | |
| F. Marinetti, L. Uranga-Pina, E. Coccia, D. Lopez-Duran, E. Bodo and F. A. Gianturco Microsolvation of cationic dimers in He-4 droplets: Geometries of A(2)(+)(He)(N) (A = Li, Na, K) from optimized energies J. Phys. Chem. A 111, 12289-12294 (2007) doi:10.1021/jp0748361 | |
| S. Bovino, E. Bodo and F. A. Gianturco Collisional quenching at ultralow energies: Controlling efficiency with internal state selection J. Chem. Phys. 127 (2007) doi:10.1063/1.2800658 | |
| D. Toffoli, P. Decleva, F. A. Gianturco and R. R. Lucchese Density functional theory for the photoionization dynamics of uracil J. Chem. Phys. 127 (2007) doi:10.1063/1.2813349 | |
| L. Gonzalez-Sanchez, E. Bodo and F. A. Gianturco Collisional quenching of rotations in lithium dimers by ultracold helium: The Li-2(a (3)Sigma(+)(u)) and Li-2(+)(X (2)Sigma(+)(g)) targets J. Chem. Phys. 127 (2007) doi:10.1063/1.2803190 |
| 2006 | |
|---|---|
| C. Piccarreta and F. Gianturco The structuring of a molecular dopant in a quantum solvent - OCS(H-2)(N) Van der Waals clusters Eur. Phys. J. D 37, 93-103 (2006) doi:10.1140/epjd/e2005-00245-y | |
| E. Yurtsever, F. Sebastianelli and F. Gianturco Fragmentation dynamics of Ne-3(+) clusters: A classical trajectory study COMPUTATIONAL MATERIALS SCIENCE 35, 163-168 (2006) doi:10.1016/j.commatsci.2005.05.002 | |
| F. Sebastianelli, E. Bodo, I. Baccarelli, C. Di Paola, F. Gianturco and M. Yurtsever Microsolvation of Li+ in bosonic helium clusters. I. Many-body effects on the structures of the small aggregates COMPUTATIONAL MATERIALS SCIENCE 35, 261-267 (2006) doi:10.1016/j.commatsci.2004.07.011 | |
| E. Bodo, M. Lara and F. Gianturco Isotopic replacement in ionic systems: The He-4(2)++He-3 -> He-3 He-4(+)+He-4 reaction J. Chem. Phys. 124 (2006) doi:10.1063/1.2155480 | |
| E. Bodo, E. Yurtsever, M. Yurtsever and F. Gianturco Ionic dimers in He droplets: Interaction potentials for Li-2(+)-He,Na-2(+)-He, and K-2(+)-He and stability of the smaller clusters J. Chem. Phys. 124 (2006) doi:10.1063/1.2172610 | |
| L. Gonzalez-Sanchez, E. Bodo and F. Gianturco Quantum scattering of OH(X-2 Pi) with He(S-1): Propensity features in rotational relaxation at ultralow energies Phys. Rev. A 73 (2006) doi:10.1103/PhysRevA.73.022703 | |
| F. Gianturco, J. Franz, R. Buenker, H. Liebermann, L. Pichl, J. Rost, M. Tachikawa and M. Kimura Positron binding to alkali-metal hydrides: The role of molecular vibrations Phys. Rev. A 73 (2006) doi:10.1103/PhysRevA.73.022705 | |
| E. Bodo and F. Gianturco Ultra low-energy behavior of an ionic replacement reaction (HeHe+)-He-3-He-4+He-4 -> He-4(2)++He-3 Phys. Rev. A 73 (2006) doi:10.1103/PhysRevA.73.032702 | |
| I. Baccarelli, F. Gianturco, T. Gonzalez-Lezana, G. Delgado-Barrio, S. Miret-Artes and P. Villarreal Rovibrational structures in floppy triatomics: Distributed Gaussian functions treatment for the Ne2H- system J. Phys. Chem. A 110, 5487-5494 (2006) doi:10.1021/jp0563890 | |
| S. Telega and F. Gianturco Modelling electron-N-2 scattering in the resonant region - Integral cross-sections from space-fixed coupled channel calculations Eur. Phys. J. D 38, 495-500 (2006) doi:10.1140/epjd/e2006-00036-0 | |
| E. Bodo, F. A. Gianturco and E. Yurtsever Vibrational quenching at ultralow energies: Calculations of the Li-2((1)Sigma(+)(g);nu >> 0)+He superelastic scattering cross sections Phys. Rev. A 73 (2006) doi:10.1103/PhysRevA.73.052715 | |
| J. Franz and F. A. Gianturco Annihilation rates of low-energy positron scattering from simple diatomic molecules NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS 247, 20-24 (2006) doi:10.1016/j.nimb.2006.01.033 | |
| E. Bodo and F. A. Gianturco Collisional quenching of molecular ro-vibrational energy by He buffer loading at ultralow energies INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY 25, 313-351 (2006) doi:10.1080/01442350600772928 | |
| F. A. Gianturco and R. R. Lucchese Electron scattering by formic acid in the gas phase: comparing measured and computed angular distributions Eur. Phys. J. D 39, 399-405 (2006) doi:10.1140/epjd/e2006-00112-5 | |
| J. Franz and F. A. Gianturco Vibrational excitation of acetylene by positron impact - The totally symmetric modes at near-threshold energies Eur. Phys. J. D 39, 407-413 (2006) doi:10.1140/epjd/e2006-00115-2 | |
| F. Marinetti, E. Bodo and F. A. Gianturco Ionic OH as dopant of helium droplets: Ab initio potential energy surfaces for OH+((3)Sigma(-))-He-4, OH-((1)Sigma(-))-He-4, and stable structures of their smaller clusters JOURNAL OF THEORETICAL & COMPUTATIONAL CHEMISTRY 5, 543-564 (2006) doi:10.1142/S0219633606002519 | |
| E. Scifoni, F. A. Gianturco, S. Y. Grebenshchikov and R. Schinke Energies and spatial features for the rotationless bound states of He-4(3)+((2)Sigma(+)(g)): A cationic core from helium cluster ionization J. Chem. Phys. 125 (2006) doi:10.1063/1.2358986 | |
| L. Gonzalez-Sanchez, F. Marinetti, E. Bodo and F. A. Gianturco OH-(X-1 Sigma(+)) collisions with He-4(S-1) at vanishing energies: a quantum analysis of rotational quenching efficiency J. Phys. B 39, S1203-S1213 (2006) doi:10.1088/0953-4075/39/19/S27 | |
| K. Willner and F. A. Gianturco Low-energy expansion of the Jost function for long-range potentials Phys. Rev. A 74 (2006) doi:10.1103/PhysRevA.74.052715 | |
| M. P. de Lara-Castells, R. Prosmiti, G. Delgado-Barrio, D. Lopez-Duran, P. Villarreal, F. A. Gianturco and J. Jellinek Polar di-halogen molecules solvated in bosonic helium clusters: The paradigm of ICl(X) Phys. Rev. A 74 (2006) doi:10.1103/PhysRevA.74.053201 | |
| I. Baccarelli, A. Grandi, F. A. Gianturco, R. R. Lucchese and N. Sanna Electron-attachment resonances of glycine zwitterions from quantum scattering calculations: Modeling macrosolvation effects JOURNAL OF PHYSICAL CHEMISTRY B 110, 26240-26247 (2006) doi:10.1021/jp065872n | |
| F. A. Gianturco and T. Stoecklin Scattering of electrons from gas-phase N2O((1)Sigma): Computed cross-sections and angular distributions in comparison with experiments Eur. Phys. J. D 40, 369-375 (2006) doi:10.1140/epjd/e2006-00170-7 | |
| C. Di Paola, E. Bodo and F. A. Gianturco Adaptive clustering of a quantum solvent: the LiH+ cation in bosonic helium from stochastic calculations Eur. Phys. J. D 40, 377-385 (2006) doi:10.1140/epjd/e2006-00184-1 | |
| S. Orlandini, I. Baccarelli and F. A. Gianturco Competitive bond breaking in floppy molecular trimers: HeNeH and HeNeH- calculations J. Chem. Phys. 125 (2006) doi:10.1063/1.2403135 | |
| S. Telega and F. A. Gianturco Electron-molecule scattering in gases at very low energies: a comparison of theory and experiment for the nitrogen ((1)Sigma(+)(g)) target Mol. Phys. 104, 3147-3154 (2006) doi:10.1080/00268970601012793 |
| 2005 | |
|---|---|
| J. del Valle and F. Gianturco Collisional 'heating' of molecular rotations by positron impact: a computational analysis of the quantum dynamics Phys. Chem. Chem. Phys. 7, 318-325 (2005) doi:10.1039/b411035h | |
| S. Irrera and F. Gianturco Vibrational excitation of CF4 by electron impact: a computational analysis NEW JOURNAL OF PHYSICS 7 (2005) doi:10.1088/1367-2630/7/1/001 | |
| F. Gianturco, T. Gonzalez-Lezana, G. Delgado-Barrio and P. Villarreal The binding of He-4 and He-3 to a hydrogen molecule: A computational study for pH(2) and oH(2) J. Chem. Phys. 122 (2005) doi:10.1063/1.1847511 | |
| I. Baccarelli, F. Gianturco, T. Gonzalez-Lezana, G. Delgado-Barrio, S. Miret-Artes and P. Villarreal A complete configurational study for the bound states of Ne trimers J. Chem. Phys. 122 (2005) doi:10.1063/1.1850096 | |
| E. Bodo, F. Gianturco and E. Yurtsever The weak Li-2-He interaction revisited: A combined ab-initio and empirical modelling. JOURNAL OF LOW TEMPERATURE PHYSICS 138, 259-264 (2005) doi:10.1007/s10909-005-1560-4 | |
| E. Bodo, F. Gianturco, F. Sebastianelli, E. Yurtsever and M. Yurtsever Rotational cooling of Li-2((1)Sigma(+)(g))molecules by ultracold collisions with an He gas buffer (vol 112, pg 263, 2004) THEORETICAL CHEMISTRY ACCOUNTS 113, 132 (2005) doi:10.1007/s00214-005-0627-2 | |
| I. Baccarelli, F. Gianturco, T. Gonzalez-Lezana, G. Delgado-Barrio, S. Miret-Artes and P. Villarreal Bound-state energies in argon trimers via a variational expansion: The effects from many-body corrections J. Chem. Phys. 122 (2005) doi:10.1063/1.1879972 | |
| M. de Lara-Castells, D. Lopez-Duran, G. Delgado-Barrio, P. Villarreal, C. Di Paola, F. Gianturco and J. Jellinek Energies and density distributions of (He-4)(N) clusters doped with Br-2(X): A Hartree-like approach Phys. Rev. A 71 (2005) doi:10.1103/PhysRevA.71.033203 | |
| T. Nishimura and F. Gianturco The dominant "heating" mode: bending excitation of water molecules by low-energy positron impact Eur. Phys. J. D 33, 221-228 (2005) doi:10.1140/epjd/e2005-00038-4 | |
| E. Bodo, F. Sebastianelli, F. Gianturco and I. Pino Microsolvation of LiH+ in helium clusters: Many-body effects and additivity models for the interaction forces J. Phys. Chem. A 109, 4252-4260 (2005) doi:10.1021/jp0448144 | |
| C. Sanz, E. Bodo and F. Gianturco Energetics and structure of the bound states in a lithium complex: The (LiH2)(+) electronic ground state Chem. Phys. 314, 135-142 (2005) doi:10.1016/j.chemphys.2005.02.006 | |
| E. Scifoni, E. Bodo and F. Gianturco Ionic reactions in He nanodroplets: The [LiHHe](+) complex and its possible energy pathways into products from ab initio calculations J. Chem. Phys. 122 (2005) doi:10.1063/1.1926270 | |
| C. Di Paola, F. Gianturco, D. Lopez-Duran, M. de Lara-Castells, G. Delgado-Barrio, P. Villarreal and J. Jellineke Br-2(X)Microsolvation in helium clusters: Effect of the interaction on quantum solvent density distribution CHEMPHYSCHEM 6, 1348-1356 (2005) doi:10.1002/cphc.200400530 | |
| J. Del Valle, E. Bodo and F. Gianturco Rotational cooling of molecular gases by positron impact at vanishing collision energies J. Phys. B 38, 2069-2077 (2005) doi:10.1088/0953-4075/38/13/001 | |
| T. Nishimura and F. Gianturco Enhanced positron annihilation in small gaseous hydrocarbons: Threshold effects from symmetric C-H bond deformations Phys. Rev. A 72 (2005) doi:10.1103/PhysRevA.72.022706 | |
| F. Gianturco, R. Lucchese, J. Langer, I. Martin, M. Stano, G. Karwasz and E. Illenberger Modelling electron-induced processes in "condensed" formic acid - Resonant states of (HCOOH)(-)(2) at low energies Eur. Phys. J. D 35, 417-428 (2005) doi:10.1140/epjd/e2005-00233-3 | |
| C. Di Paola and F. Gianturco Microsolvation of neutral dopants in small He clusters: relative locations of Li and Na atoms Eur. Phys. J. D 35, 513-520 (2005) doi:10.1140/epjd/e2005-00169-6 | |
| C. Di Paola, F. Sebastianelli, E. Bodo, I. Baccarelli, F. Gianturco and M. Yurtsever Microsolvation of Li+ in small He clusters. Li+Hen species from classical and quantum calculations JOURNAL OF CHEMICAL THEORY AND COMPUTATION 1, 1045-1054 (2005) doi:10.1021/ct050072m | |
| F. Gianturco, P. Nichols, T. Gibson and R. Lucchese Metastable trapping of low-energy positrons by cubane: A computational experiment Phys. Rev. A 72 (2005) doi:10.1103/PhysRevA.72.032724 | |
| S. Telega and F. Gianturco Vibrational inelastic electron-H-2 scattering revisited: numerically converged coupled channels space frame calculations with model interactions Eur. Phys. J. D 36, 271-280 (2005) doi:10.1140/epjd/e2005-00244-0 | |
| E. Bodo, F. Gianturco, E. Yurtsever and M. Yurtsever Neutral and ionic dopants in helium clusters: interaction forces for the Li-2(a(3)Sigma(+)(u))-He and Li-2(+)(X-2 Sigma(+)(g))-He complexes Mol. Phys. 103, 3223-3231 (2005) doi:10.1080/00268970500190963 | |
| J. A. Sabin del Valle, S. Telega and F. A. Gianturco LOW-ENERGY ROTATIONAL EXCITATION OF H-2 AND N-2 BY POSITRON IMPACT. I - COMPUTED PARTIAL CROSS SECTIONS REVISTA CUBANA DE FISICA 22, 32-36 (2005) | |
| J. A. Sabin del Valle, S. Telega and F. A. Gianturco LOW-ENERGY ROTATIONAL EXCITATION OF H-2 AND N-2 BY POSITRON IMPACT. II - COMPARISON WITH ELECTRON IMPACT REVISTA CUBANA DE FISICA 22, 37-40 (2005) |
| 2004 | |
|---|---|
| T. Nishimura and F. Gianturco Vibrational excitation of water by low-energy electron scattering: Calculations and experiments EUROPHYSICS LETTERS 65, 179-185 (2004) doi:10.1209/epl/i2003-10077-3 | |
| T. Nishimura and F. Gianturco The scattering of positrons from CF4 molecules at ultralow energies J. Phys. B 37, 215-223 (2004) doi:10.1088/0953-4075/37/1/013 | |
| F. Gianturco, R. Lucchese, A. Grandi and N. Sanna Low-energy electron scattering by cubane: Resonant states and Ramsauer-Townsend features from quantum calculations in the gas phase J. Chem. Phys. 120, 4172-4181 (2004) doi:10.1063/1.1637571 | |
| F. Gianturco and R. Lucchese Radiation damage of biosystems mediated by secondary electrons: Resonant precursors for uracil molecules J. Chem. Phys. 120, 7446-7455 (2004) doi:10.1063/1.1688320 | |
| F. Gianturco and J. Raimond Untitled Eur. Phys. J. D 29, 3-4 (2004) doi:10.1140/epjd/e2004-00039-9 | |
| E. Bodo, F. Sebastianelli, F. Gianturco, E. Yurtsever and M. Yurtsever Ab initio quantum dynamics with very weak van der Waals interactions: Structure and stability of small Li-2((1)Sigma(+)(g))-(He)(n) clusters J. Chem. Phys. 120, 9160-9166 (2004) doi:10.1063/1.1701834 | |
| S. Telega, E. Bodo and F. Gianturco Rotationally inelastic collisions of electrons with H-2 and N-2 molecules: converged space-frame calculations at low energies Eur. Phys. J. D 29, 357-365 (2004) doi:10.1140/epjd/e2004-00046-x | |
| T. Nishimura and F. Gianturco Computing vibrational effects in low-energy positron scattering from polyatomic molecules: the H2O and C2H2 stretching modes NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS 221, 24-29 (2004) doi:10.1016/j.nimb.2004.03.026 | |
| F. Gianturco and R. Lucchese Nanoscopic models for radiobiological damage: metastable precursors of dissociative electron attachment to formic acid NEW JOURNAL OF PHYSICS 6 (2004) doi:10.1088/1367-2630/6/1/066 | |
| F. Sebastianelli, I. Baccarelli, C. Di Paola and F. Gianturco Replacement equivalence of H- and argon in small (Ar)(n)H- clusters from optimized structure calculations J. Chem. Phys. 121, 2094-2104 (2004) doi:10.1063/1.1772367 | |
| A. Grandi, F. Gianturco and N. Sanna H- desorption from uracil via metastable electron capture Phys. Rev. Lett. 93 (2004) doi:10.1103/PhysRevLett.93.048103 | |
| D. Lopez-Duran, M. de Lara-Castells, G. Delgado-Barrio, P. Villarreal, C. Di Paola, F. Gianturco and J. Jellinek Raman spectra of (He)(N)-Br-2(X) clusters: The role of boson/fermion statistics in a quantum solvent J. Chem. Phys. 121, 2975-2984 (2004) doi:10.1063/1.1769369 | |
| D. Lopez-Duran, M. de Lara-Castells, G. Delgado-Barrio, P. Villarreal, C. Di Paola, F. Gianturco and J. Jellinek Role of boson-fermion statistics on the Raman spectra of Br-2(X) in helium clusters Phys. Rev. Lett. 93 (2004) doi:10.1103/PhysRevLett.93.053401 | |
| F. Gianturco and R. Lucchese Resonant capture of low-energy electrons by gas-phase glycine: A quantum dynamics calculation J. Phys. Chem. A 108, 7056-7062 (2004) doi:10.1021/jp049237y | |
| E. Scifoni, G. Dellepiane and F. Gianturco Charged cores in ionized He-4 clusters II: Ab initio calculations for the He-2(+)+He system and Many-Body fitting of the computed points Eur. Phys. J. D 30, 353-362 (2004) doi:10.1140/epjd/e2004-00108-1 | |
| E. Scifoni, E. Bodo, G. Dellepiane and F. Gianturco Charged cores in ionized He-4 clusters III: A quantum modeling for the collisional relaxation dynamics Eur. Phys. J. D 30, 363-368 (2004) doi:10.1140/epjd/e2004-00109-0 | |
| F. Sebastianelli and F. Gianturco Attachment and solvation of the H- dopant: Structures of NenH- and ArnH- clusters from energy-optimizing calculations J. Phys. Chem. A 108, 8633-8640 (2004) doi:10.1021/jp0492164 | |
| E. Bodo, F. Gianturco, N. Balakrishnan and A. Dalgarno Chemical reactions in the limit of zero kinetic energy: virtual states and Ramsauer minima in F+H-2 -> HF+H J. Phys. B 37, 3641-3648 (2004) doi:10.1088/0953-4075/37/18/007 | |
| E. Bodo, F. Gianturco, F. Sebastianelli, E. Yurtsever and M. Yurtsever Rotational cooling of Li-2((1)Sigma(+)(g)) molecules by ultracold collisions with a helium gas buffer THEORETICAL CHEMISTRY ACCOUNTS 112, 263-269 (2004) doi:10.1007/s00214-004-0586-z | |
| T. Nishimura and F. Gianturco Low-energy positron scattering: Modelling the formation of bound [M-e(+)] states in deformed polyatomic molecules EUROPHYSICS LETTERS 68, 377-383 (2004) doi:10.1209/epl/i2004-10225-3 | |
| E. Bodo and F. Gianturco Features of chemical reactions at vanishing kinetic energy: the presence of internally "hot" reagents Eur. Phys. J. D 31, 423-427 (2004) doi:10.1140/epjd/e2004-00116-1 |
| 2003 | |
|---|---|
| M. Satta, E. Scifoni and F. Gianturco Dynamical ionization of the He-4 trimer: A time-dependent modeling of its fragmentation J. Chem. Phys. 118, 2606-2611 (2003) doi:10.1063/1.1535418 | |
| C. Di Paola, F. Gianturco, G. Delgado-Barrio, S. Miret-Artes and P. Villarreal The He-4 trimer: Structure and energetics of a very unusual molecule COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS 68, 1-22 (2003) doi:10.1135/cccc20030001 | |
| R. Martinazzo, E. Bodo and F. Gianturco A modified Variable-Phase algorithm for multichannel scattering with long-range potentials COMPUTER PHYSICS COMMUNICATIONS 151, 187-198 (2003) doi:10.1016/S0010-4655(02)00737-3 | |
| F. Gianturco, R. Lucchese and N. Sanna Trapped metastable anions in low-energy electron scattering from C-20 clusters J. Chem. Phys. 118, 4013-4024 (2003) doi:10.1063/1.1540617 | |
| F. Paesani, A. Viel, F. Gianturco and K. Whaley Transition from molecular complex to quantum solvation in (HeNOCS)-He-4 Phys. Rev. Lett. 90 (2003) doi:10.1103/PhysRevLett.90.073401 | |
| R. Martinazzo, E. Bodo, F. Gianturco and M. Raimondi Three-dimensional reactive surfaces for the LiH2+ system: an analysis of accurate ab initio results Chem. Phys. 287, 335-348 (2003) doi:10.1016/S0301-0104(02)01021-2 | |
| T. Nishimura and F. Gianturco Virtual-state formation in positron scattering from vibrating molecules: A gateway to annihilation enhancement Phys. Rev. Lett. 90 (2003) doi:10.1103/PhysRevLett.90.183201 | |
| F. Sebastianelli, F. Gianturco and E. Yurtsever Finding the global minima of (Ne)(n)(+) clusters with non-empirical models: a comparison of results Chem. Phys. 290, 279-295 (2003) doi:10.1016/S0301-0104(03)00153-8 | |
| A. Occhigrossi and F. Gianturco Low-energy positron dynamics in small hydrocarbon gases J. Phys. B 36, 1383-1395 (2003) doi:10.1088/0953-4075/36/7/308 | |
| F. Sebastianelli, I. Baccarelli, C. Di Paola and F. Gianturco Structural and quantum effects from anionic centers in rare gas clusters: The (Ne)nH(-) and (Ne)(n+1) systems J. Chem. Phys. 119, 5570-5582 (2003) doi:10.1063/1.1599343 | |
| E. Bodo and F. Gianturco Collisional cooling of polar diatomics in He-3 and He-4 buffer gas: A quantum calculation at ultralow energies J. Phys. Chem. A 107, 7328-7336 (2003) doi:10.1021/jp030303q | |
| E. Bodo, F. Gianturco and R. Martinazzo The gas-phase lithium chemistry in the early universe: elementary processes, interaction forces and quantum dynamics PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS 384, 85-119 (2003) doi:10.1016/S0370-1573(03)00243-6 | |
| F. Gianturco, T. Gibson, P. Nichols, R. Lucchese and T. Nishimura Modeling dynamical correlation forces in low-energy positron scattering from polyatomic gases: a comparison for CH4 RADIATION PHYSICS AND CHEMISTRY 68, 673-680 (2003) doi:10.1016/S0969-806X(03)00198-1 | |
| F. Sebastianelli, C. Di Paola, I. Baccarelli and F. Gianturco Quantum and classical structures for He-4 clusters with the H- impurity J. Chem. Phys. 119, 8276-8288 (2003) doi:10.1063/1.1612477 | |
| R. Martinazzo, G. Tantardini, E. Bodo and F. Gianturco Accurate potential energy surfaces for the study of lithium-hydrogen ionic reactions J. Chem. Phys. 119, 11241-11248 (2003) doi:10.1063/1.1621852 |
| 2002 | |
|---|---|
| F. Gianturco, G. Kashenock, R. Lucchese and N. Sanna Low-energy resonant structures in electron scattering from C-20 fullerene J. Chem. Phys. 116, 2811-2824 (2002) doi:10.1063/1.1433964 | |
| E. Bodo, F. Gianturco and A. Dalgarno Quenching of vibrationally excited CO(nu=2) molecules by ultra-cold collisions with He-4 atoms Chem. Phys. Lett. 353, 127-130 (2002) doi:10.1016/S0009-2614(01)01501-9 | |
| R. Curik and F. Gianturco A computational analysis of low-energy electron scattering from gaseous cyclopropane J. Phys. B 35, 717-732 (2002) doi:10.1088/0953-4075/35/3/321 | |
| R. Curik and F. Gianturco Quantum calculations for resonant vibrational excitations of cyclopropane by electron impact J. Phys. B 35, 1235-1250 (2002) | |
| E. Bodo, F. Gianturco and A. Dalgarno F+D-2 reaction at ultracold temperatures J. Chem. Phys. 116, 9222-9227 (2002) doi:10.1063/1.1472515 | |
| P. Carsky, R. Curik, F. Gianturco, R. Lucchese and M. Polasek Computing the exchange interaction in electron scattering from polyatomic molecules Phys. Rev. A 65 (2002) doi:10.1103/PhysRevA.65.052713 | |
| F. Paesani and F. Gianturco Vibrational effects in a weakly-interacting quantum solvent: The CO molecule in He-4 gas and in He-4 droplets J. Chem. Phys. 116, 10170-10182 (2002) doi:10.1063/1.1478690 | |
| F. Gianturco Thematic issue - Structure and dynamics of weakly bound clusters and aggregates - Preface COMPUTER PHYSICS COMMUNICATIONS 145, XI-XII (2002) doi:10.1016/S0010-4655(02)00144-3 | |
| F. Gianturco and F. Filippone Structure and dynamics of small protonated rare-gas clusters using quantum and classical methods COMPUTER PHYSICS COMMUNICATIONS 145, 78-96 (2002) doi:10.1016/S0010-4655(02)00148-0 | |
| T. Gonzalez-Lezana, S. Miret-Artes, G. Delgado-Barrio, P. Villarreal, J. Rubayo-Soneira, I. Baccarelli, F. Paesani and F. Gianturco A variational method to treat diffuse states in weakly bound trimers COMPUTER PHYSICS COMMUNICATIONS 145, 156-183 (2002) doi:10.1016/S0010-4655(02)00152-2 | |
| E. Bodo, F. Gianturco and A. Dalgarno The reaction of F+D-2 at ultra-low temperatures: the effect of rotational excitation J. Phys. B 35, 2391-2396 (2002) doi:10.1088/0953-4075/35/10/316 | |
| M. Satta, E. Bodo, R. Martinazzo and F. Gianturco Photoexcitation of LiH2+ from selected initial states: A time-dependent model J. Chem. Phys. 117, 177-186 (2002) doi:10.1063/1.1482695 | |
| F. Paesani and F. Gianturco Cluster nucleation effects in CO(Ar)(n): A stochastic analysis J. Chem. Phys. 117, 709-718 (2002) doi:10.1063/1.1482430 | |
| T. Nishimura and F. Gianturco Positron-impact vibrational excitation of CH4: Comparing calculations with experiments for the symmetric and antisymmetric stretching modes NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS 192, 17-25 (2002) doi:10.1016/S0168-583X(02)00701-2 | |
| T. Nishimura and F. Gianturco Vibrational excitation of methane by positron impact: Computed quantum dynamics and sensitivity tests Phys. Rev. A 65 (2002) doi:10.1103/PhysRevA.65.062703 | |
| C. Di Paola, F. Gianturco, F. Paesani, G. Delgado-Barrio, S. Miret-Artes, P. Villarreal, I. Baccarelli and T. Gonzalez-Lezana Ground states of weakly bound three-atom systems: energies and shapes of (He2X)-He-4 clusters from Monte Carlo calculations J. Phys. B 35, 2643-2660 (2002) | |
| T. Nishimura and F. Gianturco Vibrational excitations of CH(4) by electron-impact: a close-coupling treatment J. Phys. B 35, 2873-2887 (2002) doi:10.1088/0953-4075/35/13/303 | |
| T. Nishimura and F. Gianturco Threshold efficiency of vibrational excitation of methane by electron/positron impact: A comparison EUROPHYSICS LETTERS 59, 674-680 (2002) doi:10.1209/epl/i2002-00178-y | |
| F. Sebastianelli, E. Yurtsever and F. Gianturco Modelling ionic nucleation in small neon clusters Int. J. Mass. Spectrom. 220, 193-209 (2002) doi:10.1016/S1387-3806(02)00683-8 | |
| R. Lucchese and F. Gianturco Electron-molecule collisions in the static-exchange correlation-polarization approximation 636, 213-220 (2002) | |
| M. Satta, F. Sebastianelli and F. Gianturco Nucleation dynamics in neon trimer photoionization: a time-dependent modelling Mol. Phys. 100, 3699-3710 (2002) doi:10.1080/00268970210161520 | |
| E. Scifoni and F. Gianturco Charged cores in ionized He-4 clusters - I: The He-2(+)... He system Eur. Phys. J. D 21, 323-333 (2002) doi:10.1140/epjd/e2002-00211-3 | |
| E. Bodo, E. Scifoni, F. Sebastianelli, F. Gianturco and A. Dalgarno Rotational quenching in ionic systems at ultracold temperatures Phys. Rev. Lett. 89 (2002) doi:10.1103/PhysRevLett.89.283201 |
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| R. Curik, F. Gianturco, R. Lucchese and N. Sanna Low-energy electron scattering and resonant states of NO2((X)over-tilde (2)A(1)) J. Phys. B 34, 59-79 (2001) doi:10.1088/0953-4075/34/1/305 | |
| M. Cascella, R. Curik, F. Gianturco and N. Sanna Electron-impact vibrational excitation of polyatomic gases: Exploratory calculations J. Chem. Phys. 114, 1989-2000 (2001) doi:10.1063/1.1336567 | |
| F. Gianturco and R. Lucchese Electron scattering from gaseous SF6: Comparing calculations with experiments J. Chem. Phys. 114, 3429-3439 (2001) doi:10.1063/1.1343900 | |
| T. Gonzalez-Lezana, D. Lopez, S. Miret-Artes, F. Gianturco, G. Delgado-Barrio and P. Villarreal Rotation-vibration interaction in He-4 trimers Chem. Phys. Lett. 335, 105-110 (2001) doi:10.1016/S0009-2614(00)01423-8 | |
| F. Gianturco, F. Paesani, I. Baccarelli, G. Delgado-Barrio, T. Gonzalez-Lezana, S. Miret-Artes, P. Villarreal, G. Bendazzoli and S. Evangelisti The structure of a weakly bound ionic trimer: Calculations for the (He2H-)-He-4 complex J. Chem. Phys. 114, 5520-5530 (2001) doi:10.1063/1.1352034 | |
| F. Gianturco and F. Paesani The rovibrational structure of the He-CO complex from a model interaction potential Mol. Phys. 99, 689-698 (2001) doi:10.1080/00268970010028836 | |
| M. Cascella, R. Curik and F. Gianturco Vibrational excitation in electron-CH4 collisions: exchange interaction effects J. Phys. B 34, 705-723 (2001) doi:10.1088/0953-4075/34/5/301 | |
| T. Gonzalez-Lezana, J. Rubayo-Soneira, S. Miret-Artes, F. Gianturco, G. Delgado-Barrio and P. Villarreal Comment on ``Efimov states for He-4 trimers?” - Reply Phys. Rev. Lett. 86, 4190 (2001) doi:10.1103/PhysRevLett.86.4190 | |
| F. Gianturco and T. Stoecklin Low-energy electron scattering from CO2 molecules: elastic channel calculations revisited J. Phys. B 34, 1695-1710 (2001) doi:10.1088/0953-4075/34/9/308 | |
| M. Ceotto and F. Gianturco Internal coordinate couplings and symmetry properties: The search of a conical seam in protonated oxygen J. Phys. Chem. A 105, 5197-5205 (2001) doi:10.1021/jp002748+ | |
| F. Gianturco and F. Paesani The rovibrational structure of the Ar-CO complex from a model interaction potential J. Chem. Phys. 115, 249-256 (2001) doi:10.1063/1.1377604 | |
| M. Ceotto and F. Gianturco Gas-phase proton affinity of ozone: a computational test of the experimental mechanism JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM 543, 115-122 (2001) doi:10.1016/S0166-1280(00)00850-2 | |
| R. Martinazzo, A. Famulari, M. Raimondi, E. Bodo and F. Gianturco A multireference valence bond approach to electronic excited states J. Chem. Phys. 115, 2917-2925 (2001) doi:10.1063/1.1388043 | |
| F. Gianturco and T. Mukherjee Addendum ``Dynamical coupling effects in the vibrational excitation of H-2 and N-2 colliding with positrons” Phys. Rev. A 64 (2001) doi:10.1103/PhysRevA.64.024703 | |
| R. Curik, F. Gianturco and N. Sanna The close-coupling-single center-expansion (CC-SCE) model for electron scattering from polyatomic targets INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 84, 565-579 (2001) doi:10.1002/qua.1411 | |
| F. Gianturco and R. Lucchese Cross sections and asymmetry parameters in gas-phase photoionization of C-60 Phys. Rev. A 64 (2001) doi:10.1103/PhysRevA.64.032706 | |
| F. Gianturco, T. Mukherjee and A. Occhigrossi Computing positron annihilation in polyatomic gases: An exploratory study Phys. Rev. A 64 (2001) doi:10.1103/PhysRevA.64.032715 | |
| E. Bodo, F. Gianturco, R. Martinazzo and M. Raimondi Possible reaction paths in the LiH2+ chemistry: a computational analysis of the interaction forces Chem. Phys. 271, 309-321 (2001) doi:10.1016/S0301-0104(01)00424-4 | |
| E. Bodo, F. Gianturco, R. Martinazzo and M. Raimondi Computed orientational anisotropy and vibrational couplings for the LiH+H interaction potential Eur. Phys. J. D 15, 321-329 (2001) doi:10.1007/s100530170147 | |
| F. Paesani, F. Gianturco and K. Whaley Molecular evidence for selective localization of a quantum solvent: OCS in helium droplets EUROPHYSICS LETTERS 56, 658-664 (2001) doi:10.1209/epl/i2001-00571-0 | |
| F. Paesani, F. Gianturco and K. Whaley Microsolvation and vibrational shifts of OCS in helium clusters J. Chem. Phys. 115, 10225-10238 (2001) doi:10.1063/1.1412873 | |
| E. Bodo, F. Gianturco, R. Martinazzo and M. Raimondi Reactive behavior of the [LiH2](+) system I. Evaluation of the lower-lying electronic potentials for the collinear geometries J. Phys. Chem. A 105, 10986-10993 (2001) doi:10.1021/jp0123435 | |
| E. Bodo, F. Gianturco and R. Martinazzo Reactive behavior of the [LiH2](+) system II. Collision-induced dissociation and collinear reaction dynamics of LiH++H from quantum time dependent calculations J. Phys. Chem. A 105, 10994-11000 (2001) doi:10.1021/jp012344x | |
| D. Field, J. Ziesel, S. Lunt, R. Parthasarathy, L. Suess, S. Hill, F. Dunning, R. Lucchese and F. Gianturco Very low-energy electron scattering from benzene: experiment and theory J. Phys. B 34, 4371-4381 (2001) doi:10.1088/0953-4075/34/22/308 | |
| F. Gianturco, T. Mukherjee, T. Nishimura and A. Occhigrossi Low-energy positron dynamics in polyatomic gases , 451-474 (2001) doi: | |
| R. Lucchese, F. Gianturco, P. Nichols and T. Gibson A test calculation on SF6 of model potentials for correlation and polarization effects in positron scattering from molecules , 475-492 (2001) doi: |