• 24 Citations
  • 3 h-Index
20142018
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Research Output 2015 2018

  • 24 Citations
  • 3 h-Index
  • 5 Article
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Article
2018
23 Downloads (Pure)

Investigation of the Electronic Excited-State Equilibrium Geometries of Three Molecules Undergoing ESIPT: A RI-CC2 and TDDFT Study

Louant, O., Champagne, B. & Liégeois, V., 1 Feb 2018, In : Journal of physical chemistry A. 122, 4, p. 972-984 13 p., DOI: 10.1021/acs.jpca.7b10881.

Research output: Contribution to journalArticle

Open Access
File
Excited states
Molecules
Geometry
Excitation energy
geometry
Absorption spectroscopy
Excited states
absorption spectroscopy
Excitation energy
tautomers
2017

Faraday Effect in Stacks of Aromatic Molecules

Louant, O., Liégeois, V., Verbiest, T., Persoons, A. & Champagne, B., 20 Jul 2017, In : Journal of Physical Chemistry C. 121, 28, p. 15348-15352 5 p.

Research output: Contribution to journalArticle

Faraday effect
oligomers
Oligomers
Quantum chemistry
Oligomerization
2016
12 Downloads (Pure)

Analytic calculations of anharmonic infrared and Raman vibrational spectra

Cornaton, Y., Ringholm, M., Louant, O. & Ruud, K., 2016, In : Physical Chemistry Chemical Physics. 18, 5, p. 4201-4215 15 p.

Research output: Contribution to journalArticle

Open Access
File
Vibrational spectra
vibrational spectra
Raman spectra
Infrared radiation
Derivatives
2015
8 Downloads (Pure)
numerical differentiation
molecular properties
Dipole moment
Excited states
Ground state