- Title
- On the applicability of a wavefunction-free, energy-based procedure for generating first-order non-adiabatic couplings around conical intersections
- Creators - without role
- Benjamin Gonon - Université de Montpellier, Institut Charles Gerhardt Montpellier - ICGMAurelie Perveaux - Université de MontpellierFabien Gatti - Université de Montpellier, Institut Charles Gerhardt Montpellier - ICGMDavid Lauvergnat - Laboratoire de Chimie PhysiqueBenjamin Lasorne - Université de Montpellier, Institut Charles Gerhardt Montpellier - ICGM
- Publication Details
- The Journal of Chemical Physics, Vol.147(11)
- Identifiers
- 9946989109311
- Academic Unit
- Institut Charles Gerhardt Montpellier - ICGM
- Language
- English
- Resource Type
- Journal article
- Local Fields
- hal-02343838
Journal article
On the applicability of a wavefunction-free, energy-based procedure for generating first-order non-adiabatic couplings around conical intersections
The Journal of Chemical Physics, Vol.147(11)
21/09/2017
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