|
|||||
|
|
Quantum chemical topology from tight augmented core densities |
|
| Authors: | Julien Pilmé |
| Institution: | Sorbonne Université, CNRS, Laboratoire de Chimie Théorique, CC 137 – 4, place Jussieu F. 75252 PARIS CEDEX 05, France |
| Abstract: | |
| Keywords: | core density ECP electron localization function ELF QTAIM quantum chemical topology |