Nicolas Ferré

3PUBLICATIONS
43CO-AUTHORS
Radiation and matterComputational chemistryStatistical mechanics, physical combinatorics and mathematical aspects of condensed matter
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Publications (3)

|Aug 11, 2020
Improved evaluation of spin-polarization energy contributions using broken-symmetry calculations.

Grégoire David, Nicolas Ferré, Georges Trinquier

|Jun 08, 2020
Modern quantum chemistry with [Open]Molcas.

Francesco Aquilante, Jochen Autschbach, Alberto Baiardi

|Aug 03, 2019
Analytic QM/MM atomic charge derivatives avoiding the scaling of coupled perturbed equations with the MM subsystem size.

Karno Schwinn, Nicolas Ferré, Miquel Huix-Rotllant

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