Peter Reinhardt, Ph.D.
Affiliations: | Chemistry | Université Pierre et Marie Curie, Paris, Île-de-France, France |
Area:
Theoretical ChemistryWebsite:
http://www.lct.jussieu.fr/pagesperso/reinhGoogle:
"Peter Reinhardt"Mean distance: 11.68 | S | N | B | C | P |
Cross-listing: Physics Tree
Parents
Sign in to add mentor| Bernd Arthur Heß | grad student | 1990-1995 | Universität Bonn | |
| (Ab-initio-Untersuchungen an periodischen Strukturen am Beispiel von Rutiloberflächen) | ||||
| Peter Fulde | post-doc | 1998 | Max-Planck Institute | |
| (1999) | ||||
| Jean-Paul Malrieu | post-doc | 1996-1998 | Université de Toulouse | |
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Publications
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| Garniron Y, Applencourt T, Gasperich K, et al. (2019) Quantum Package 2.0: An Open-Source Determinant-Driven Suite of Programs. Journal of Chemical Theory and Computation |
| Reinhardt P, Toulouse J, Savin A. (2018) Range-separated density-functional theory applied to the beryllium dimer and trimer Theoretical Chemistry Accounts. 137 |
| Amara S, Tchouar N, Reinhardt P, et al. (2017) Study of the structure, the electronic and spectral properties of D-glucaro-dilactones Journal of King Saud University - Science. 31: 427-433 |
| Weber F, Müller C, Paulus B, et al. (2016) Calculation of Zn, Cd, Hg adsorption on graphene with incremental CCSD(T) and range-separated hybrid DFT* Molecular Physics. 1-12 |
| Wu JC, Piquemal JP, Chaudret R, et al. (2010) Polarizable molecular dynamics simulation of Zn(II) in water using the AMOEBA force field. Journal of Chemical Theory and Computation. 6: 2059-2070 |
| Zhang H, Malrieu JP, Reinhardt P, et al. (2010) Improved version of a local contracted configuration interaction of singles and doubles with partial inclusion of triples and quadruples. The Journal of Chemical Physics. 132: 034108 |
| Reinhardt P, Piquemal JP. (2009) New intermolecular benchmark calculations on the water dimer: Sapt and supermolecular post-hartree-fock approaches International Journal of Quantum Chemistry. 109: 3259-3267 |
| Reinhardt P, Hoggan PE. (2009) Cusps and derivatives for wave-functions expanded in slater orbitals: A density study International Journal of Quantum Chemistry. 109: 3191-3198 |
| Reinhardt P, Piquemal JP, Savin A. (2008) Fragment-Localized Kohn-Sham Orbitals via a Singles Configuration-Interaction Procedure and Application to Local Properties and Intermolecular Energy Decomposition Analysis. Journal of Chemical Theory and Computation. 4: 2020-9 |
| Reinhardt P, Zhang H, Ma J, et al. (2008) A local contracted treatment of single and double excitations. The Journal of Chemical Physics. 129: 164106 |