검색결과 : 3건
| No. | Article |
|---|---|
| 1 |
Investigation of the Electronic Excited-State Equilibrium Geometries of Three Molecules Undergoing ESIPT: A RI-CC2 and TDDFT Study Louant O, Champagne B, Liegeois V Journal of Physical Chemistry A, 122(4), 972, 2018 |
| 2 |
Predicting Keto-Enol Equilibrium from Combining UV/Visible Absorption Spectroscopy with Quantum Chemical Calculations of Vibronic Structures for Many Excited States. A Case Study on Salicylideneanilines Zutterman F, Louant O, Mercier G, Leyssens T, Champagne B Journal of Physical Chemistry A, 122(24), 5370, 2018 |
| 3 |
Numerical differentiation method to calculate molecular properties at ground and excited states - Application to Julolidinemalononitrile Louant O, Champagne B, Liegeois V Chemical Physics Letters, 634, 249, 2015 |