Luc-Henri Jolly
Luc-Henri Jolly
Ingénieur CNRS, Sorbonne Université
Adresse e-mail validée de upmc.fr
TitreCitée parAnnée
Tinker-HP: a massively parallel molecular dynamics package for multiscale simulations of large complex systems with advanced point dipole polarizable force fields
L Lagardère, LH Jolly, F Lipparini, F Aviat, B Stamm, ZF Jing, M Harger, ...
Chemical science 9 (4), 956-972, 2018
512018
Periodic Hartree-Fock study of minerals: hexacoordinated SiO2 and GeO2 polymorphs
LH Jolly, B Silvi, P D’arco
European journal of mineralogy, 7-16, 1994
291994
OSIPE—a tool for scientific programming in FORTRAN
F Colonna, LH Jolly, RA Poirier, JG Ángyán, G Jansen
Computer physics communications 81 (3), 293-317, 1994
151994
Pseudopotential periodic Hartree-Fock study of the cristobalite to stishovite phase transition
B Silvi, LH Jolly, P D'Arco
Journal of Molecular Structure: THEOCHEM 260, 1-9, 1992
141992
Periodic Hartree-Fock study of B1⇌ B2 reactions: phase transition in CaO
P D'Arco, LH Jolly, B Silvi
Physics of the Earth and Planetary interiors 72 (3-4), 286-298, 1992
111992
Extended Gaussian‐type valence basis sets for calculations involving nonempirical core pseudopotentials. II. PS‐21 G Basis for Li to Ca and Ga to Kr atoms
Y Hannachi, JC Barthelat, LH Jolly, B Silvi, Y Bouteiller
International journal of quantum chemistry 42 (3), 509-521, 1992
71992
Periodic Hartree-Fock investigation of the stishovite CaCI2-like phase transition of silica
LH Jolly, B Silvi, P d'Arco
Journal de chimie physique 90, 1887-1895, 1993
61993
Raising the performance of the Tinker-HP molecular modeling package [article v1. 0]
LH Jolly, A Duran, L Lagardère, JW Ponder, P Ren, JP Piquemal
LiveCoMS 1 (10409), 10.33011, 2019
22019
Reconciling NMR Structures of the HIV-1 Nucleocapsid Protein (NCp7) using Extensive Polarizable Force Field Free-Energy Simulations
L El Khoury, F Célerse, L Lagardère, LH Jolly, E Derat, Z Hobaika, ...
ChemRxiv, 2019
2019
The CH fragment as a model for interpreting the variations of the 3.3 mum band in PAHs
F Pauzat, Y Ellinger, B Silvi, LH Jolly
Molecules in Space and Laboratory, 2007
2007
ETUDE HARTREE-FOCK PERIODIQUE DES TRANSITIONS DE PHASE INDUITES PAR LA PRESSION: APPLICATION AUX POLYMORPHES DE MGO, CAO, SIO# 2 ET GEO# 3
LUC-HENRI.. JOLLY
1993
Etude hartree-fock periodique des transitions de phase induites par la pression: application aux polymorphes de mgo, cao, sio# 2 et geo# 3
LUCH JOLLY
Paris 6, 1993
1993
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