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 |
0.539 |
|
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 |
0.414 |
|
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 |
0.541 |
|
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 |
0.536 |
|
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 |
0.475 |
|
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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