2015
Ultrafast IR Spectroscopy of O-H Stretching Modes in 2-Naphthol-Acetonitrile Photoacid-Base Complexes
Psciuk B, Prémont-Schwartz M, Koeppe B, Keinan S, Xiao D, Batista V, Nibbering E. Ultrafast IR Spectroscopy of O-H Stretching Modes in 2-Naphthol-Acetonitrile Photoacid-Base Complexes. Springer Proceedings In Physics 2015, 162: 483-486. DOI: 10.1007/978-3-319-13242-6_118.Peer-Reviewed Original Research
2011
The O–H Stretching Mode of a Prototypical Photoacid as a Local Dielectric Probe
Prémont-Schwarz M, Xiao D, Batista V, Nibbering E. The O–H Stretching Mode of a Prototypical Photoacid as a Local Dielectric Probe. The Journal Of Physical Chemistry A 2011, 115: 10511-10516. PMID: 21851092, DOI: 10.1021/jp207642k.Peer-Reviewed Original ResearchDensity functional theoryFemtosecond mid-infrared spectroscopySolvatochromic effectH stretching modeB3LYP/TZVPVibrational frequency shiftsMid-infrared spectroscopyNuclear rearrangementsFrequency shiftPerturbative approachFunctional theoryDielectric responseStretching modeDielectric probeTZVP levelTheoretical modelPhotoacidSpectroscopyTZVPStateChromophoreTheoryProbeAgreementMode