Non-adiabatic effects in thermochemistry, spectroscopy and kinetics: the general importance of all three Born-Oppenheimer breakdown corrections.
about
Potential-Energy Surfaces, the Born-Oppenheimer Approximations, and the Franck-Condon Principle: Back to the Roots.Nodeless vibrational amplitudes and quantum nonadiabatic dynamics in the nested funnel for a pseudo Jahn-Teller molecule or homodimer.Coherent wavepackets in the Fenna-Matthews-Olson complex are robust to excitonic-structure perturbations caused by mutagenesis.The best of both Reps-Diabatized Gaussians on adiabatic surfaces.Electron-vibration entanglement in the Born-Oppenheimer description of chemical reactions and spectroscopy.Bond angle variations in XH3 [X = N, P, As, Sb, Bi]: the critical role of Rydberg orbitals exposed using a diabatic state model.
P2860
Non-adiabatic effects in thermochemistry, spectroscopy and kinetics: the general importance of all three Born-Oppenheimer breakdown corrections.
description
2015 nî lūn-bûn
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2015年の論文
@ja
2015年学术文章
@wuu
2015年学术文章
@zh-cn
2015年学术文章
@zh-hans
2015年学术文章
@zh-my
2015年学术文章
@zh-sg
2015年學術文章
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2015年學術文章
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2015年學術文章
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name
Non-adiabatic effects in therm ...... nheimer breakdown corrections.
@en
Non-adiabatic effects in therm ...... nheimer breakdown corrections.
@nl
type
label
Non-adiabatic effects in therm ...... nheimer breakdown corrections.
@en
Non-adiabatic effects in therm ...... nheimer breakdown corrections.
@nl
prefLabel
Non-adiabatic effects in therm ...... nheimer breakdown corrections.
@en
Non-adiabatic effects in therm ...... nheimer breakdown corrections.
@nl
P2860
P50
P356
P1476
Non-adiabatic effects in therm ...... nheimer breakdown corrections.
@en
P2860
P304
24641-24665
P356
10.1039/C5CP02238J
P407
P577
2015-07-21T00:00:00Z