Bernard Levy, Ph.D. - Publications

Chemistry Université Paris-Sud, Orsay / CNRS 
Theoretical Chemistry

33 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2015 Narth C, Gillet N, Cailliez F, Lévy B, de la Lande A. Electron transfer, decoherence, and protein dynamics: insights from atomistic simulations. Accounts of Chemical Research. 48: 1090-7. PMID 25730126 DOI: 10.1021/Ar5002796  0.325
2014 Gillet N, Lévy B, Moliner V, Demachy I, de la Lande A. Electron and Hydrogen Atom Transfers in the Hydride Carrier Protein EmoB. Journal of Chemical Theory and Computation. 10: 5036-46. PMID 26584385 DOI: 10.1021/Ct500173Y  0.326
2009 Praud L, Levy B, Millie P, Berthier G. Ab Initio second-order perturbation calculations for excited and ionized states of benzene isomers International Journal of Quantum Chemistry. 7: 185-191. DOI: 10.1002/Qua.560070724  0.367
2006 Lévy B, Millié P, Spiegelman F, Sanchez-Marin J, Guihéry N. About the scientific contribution of Jean-Paul Malrieu Theoretical Chemistry Accounts. 116: 383-389. DOI: 10.1007/S00214-006-0152-Y  0.547
2005 Demachy I, Ridard J, Laguitton-Pasquier H, Durnerin E, Vallverdu G, Archirel P, Lévy B. Cyan fluorescent protein: molecular dynamics, simulations, and electronic absorption spectrum. The Journal of Physical Chemistry. B. 109: 24121-33. PMID 16375404 DOI: 10.1021/Jp054656W  0.317
2004 Renou F, Archirel P, Pernot P, Lévy B, Mostafavi M. Pulse Radiolysis Study of Solvated Electron Pairing with Alkaline Earth Metals in Tetrahydrofuran. 3. Splitting of p-Like Excited States of Solvated Electron Perturbed by Metal Cations Journal of Physical Chemistry A. 108: 987-995. DOI: 10.1021/Jp035899W  0.54
2003 Nicolas C, Boutin A, Lévy B, Borgis D. Molecular simulation of a hydrated electron at different thermodynamic state points The Journal of Chemical Physics. 118: 9689-9696. DOI: 10.1063/1.1570407  0.312
2002 Enescu M, Ridard J, Gheorghe aV, Levy B. Electron Transfer Modeling in Condensed Phase by Molecular Dynamics Simulation: Application to Methylene Blue-Guanine Complex in Water Journal of Physical Chemistry B. 106: 176-184. DOI: 10.1021/Jp011891F  0.334
2000 Dognon JP, Durand S, Granucci G, Lévy B, Millié P, Rabbe C. Atomic charges for molecular dynamics calculations Journal of Molecular Structure: Theochem. 507: 17-23. DOI: 10.1016/S0166-1280(99)00343-7  0.604
1996 Dulieu O, Lévy B, Magnier S, Masnou-Seeuws F, Millié P. Long range potentials for two Na3p atoms including ionic-covalent interaction and fine structure: Application to two-color photoassociation spectroscopy. Physical Review Letters. 76: 2858-2861. PMID 10060809 DOI: 10.1103/Physrevlett.76.2858  0.585
1996 Reynaud C, Gaveau MA, Bisson K, Millié P, Nenner I, Bodeur S, Archirel P, Lévy B. Double-core ionization and excitation above the sulphur K-edge in H2S, SO2 and SF6 Journal of Physics B: Atomic, Molecular and Optical Physics. 29: 5403-5419. DOI: 10.1088/0953-4075/29/22/017  0.613
1996 Reynaud C, Gaveau MA, Millié P, Bodeur S, Archirel P, Lévy B, Nenner I. Double core excitation at the sulfur K edge in H2S, SO2 and SF6 Journal of Electron Spectroscopy and Related Phenomena. 79: 357-360. DOI: 10.1016/0368-2048(96)02872-1  0.316
1994 Rayez MT, Halvick P, Rayez JC, Millié P, Lévy B. Ab initio study of the potential energy surfaces for the reaction N(4Su +CH(X 2IIr) → CN(X 2Σ+, A 2IIi + H(2Sg) Chemical Physics. 188: 161-170. DOI: 10.1016/0301-0104(94)00233-9  0.597
1993 Pernot P, Pansu R, Levy B, Faure J. Theoretical study of the diffusion of large molecules in micro-heterogeneous media. The Smoluchovski approach Chemical Physics. 177: 793-802. DOI: 10.1016/0301-0104(93)85042-7  0.416
1988 Ridard J, Levy B, Millié P. Theoretical investigation of the dissociation of OCS2+ in the process OCS(X 1Σ+) + hv → OCS2+ → CO+ (X2Σ+) + S+ (4S) Chemical Physics. 122: 403-412. DOI: 10.1016/0301-0104(88)80022-3  0.61
1988 Pernot P, Atabek O, Beswick JA, Levy B. Reduced-diabatic vibrational close coupled treatment of molecular dissociation dynamics International Journal of Quantum Chemistry. 34: 161-184. DOI: 10.1002/Qua.560340208  0.542
1985 Chambaud G, Lévy B, Pernot P. Transfer of electronic excitation: The Arh system Chemical Physics. 95: 299-303. DOI: 10.1016/0301-0104(85)80082-3  0.538
1984 Chambaud G, Gérard-Aïn M, Kassab E, Lévy B, Pernot P. Valence-bond calculations with polarized atomic orbitals Chemical Physics. 90: 271-289. DOI: 10.1016/0301-0104(84)85325-2  0.477
1980 Pauzat F, Levy B, Millie PH. Ab initio determination of vibrational band intensities I.1a2←1a1 transition of formaldehyde Molecular Physics. 39: 375-390. DOI: 10.1080/00268978000100321  0.729
1980 Chambaud G, Launay JM, Lévy B, Millié P, Roueff E, Minh FT. Charge Exchange and Fine Structure Excitation in O-H+ Collisions Symposium - International Astronomical Union. 87: 287-288. DOI: 10.1017/S0074180900072715  0.555
1980 Pauzat F, Millie P, Levy B. Computational experiments on dichroic effects in acetaldehyde Chemical Physics Letters. 71: 494-499. DOI: 10.1016/0009-2614(80)80211-9  0.732
1980 Chambaud G, Levy B, Millié P. Perturbation calculation of transition moments in the ArH+ system International Journal of Quantum Chemistry. 18: 49-55. DOI: 10.1002/Qua.560180110  0.33
1977 Kutzelnigg W, Meunier A, Lévy B, Berthier G. On the dependence of the energy given by a CI limited to double substitutions with respect to the number of electrons International Journal of Quantum Chemistry. 12: 777-779. DOI: 10.1002/Qua.560120414  0.519
1977 Lévy B, Berthier G. Relationship between orthogonalization and orbital localization procedures International Journal of Quantum Chemistry. 12: 579-590. DOI: 10.1002/qua.560120316  0.592
1976 Meunier A, Levy B, Berthier G. The N2 problem in molecular CI calculations International Journal of Quantum Chemistry. 10: 1061-1070. DOI: 10.1002/Qua.560100617  0.316
1975 Ellinger Y, Subra R, Levy B, Millie P, Berthier G. Ab initio study of the electronic structure and hyperfine coupling properties in simple hydrocarbon radicals. II. Short-range and long-range interactions in alkyl free radicals The Journal of Chemical Physics. 62: 10-29. DOI: 10.1063/1.430252  0.656
1975 Barbier C, Berthier G, Levy B, Millie P, Noël P. Étude théorique des constantes de couplage nucléaires 2J dans une chaine saturée par une méthode de double perturbation Journal De Chimie Physique. 72: 859-862. DOI: 10.1051/Jcp/1975720859  0.639
1975 Ellinger Y, Subra R, Levy B, Millie P, Berthier G. Ab Initio Study Of The Electronic Structure And Hyperfine Coupling Properties In Simple Hydrocarbon Radicals Part 2, Short-Range And Long-Range Interactions In Alkyl Free Radicals Cheminform. 6. DOI: 10.1002/Chin.197516091  0.308
1973 Meunier A, Lévy B, Berthier G. Electron correlation and basis effects in the theory of hydrogen bonds: The mixed dimer ammonia-water | Corrélation électronique et effets de base dans l'étude de la liaison hydrogène: le dimère mixte ammoniac-eau Theoretica Chimica Acta. 29: 49-55. DOI: 10.1007/Bf00528166  0.645
1972 Pauzat F, Ridard J, Levy B. Ab initio calculation of the lowest ionization potential and transition energies of methane Molecular Physics. 23: 1163-1178. DOI: 10.1080/00268977200101131  0.723
1972 Barbier C, Lévy B, Millié P. Coupling of geminal protons in nuclear magnetic resonance Chemical Physics Letters. 17: 122-126. DOI: 10.1016/0009-2614(72)80342-7  0.511
1971 Barbier C, Gagnaire D, Berthier G, Levy B. Double perturbation calculation of the Jgem nuclear spin-spin coupling constant of methane Journal of Magnetic Resonance (1969). 5: 11-22. DOI: 10.1016/0022-2364(71)90058-8  0.654
1970 Berthier G, Lévy B, Paoloni L. The electronic structure of N-methyl-3pyridone and its representation Theoretica Chimica Acta. 16: 316-318. DOI: 10.1007/BF00529433  0.602
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