Journal Articles
Journal of Computational Chemistry
Year : 2006
Jean-Philip Piquemal : Connect in order to contact the contributor
https://hal.science/hal-02127159
Submitted on : Monday, May 13, 2019-11:35:25 AM
Last modification on : Friday, June 2, 2023-3:14:38 PM
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Christophe Gourlaouen, Jean-Philip Piquemal, Trond Saue, Olivier Parisel. Revisiting the geometry of nd10 (n+1)s0 [M(H2O)]p+ complexes using four-component relativistic DFT calculations and scalar relativistic correlated CSOV energy decompositions (Mp+ = Cu+, Zn2+, Ag+, Cd2+, Au+, Hg2+). Journal of Computational Chemistry, 2006, 27 (2), pp.142-156. ⟨10.1002/jcc.20329⟩. ⟨hal-02127159⟩
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