Ab initio calculations on the excited states of Na3 cluster to explore beyond Born-Oppenheimer theories: adiabatic to diabatic potential energy surfaces and nuclear dynamics.
about
The Jahn-Teller plus pseudo-Jahn-Teller vibronic problem in the C3 radical and its topological implications.Beyond Born-Oppenheimer theory for ab initio constructed diabatic potential energy surfaces of singlet H3+ to study reaction dynamics using coupled 3D time-dependent wave-packet approach.Ab initio constructed diabatic surfaces of NO2 and the photodetachment spectra of its anion.
P2860
Ab initio calculations on the excited states of Na3 cluster to explore beyond Born-Oppenheimer theories: adiabatic to diabatic potential energy surfaces and nuclear dynamics.
description
2011 nî lūn-bûn
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2011年の論文
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2011年学术文章
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2011年学术文章
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2011年学术文章
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2011年學術文章
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name
Ab initio calculations on the ...... surfaces and nuclear dynamics.
@en
Ab initio calculations on the ...... surfaces and nuclear dynamics.
@nl
type
label
Ab initio calculations on the ...... surfaces and nuclear dynamics.
@en
Ab initio calculations on the ...... surfaces and nuclear dynamics.
@nl
prefLabel
Ab initio calculations on the ...... surfaces and nuclear dynamics.
@en
Ab initio calculations on the ...... surfaces and nuclear dynamics.
@nl
P2093
P2860
P356
P1476
Ab initio calculations on the ...... surfaces and nuclear dynamics.
@en
P2093
Amit Kumar Paul
Debasis Mukhopadhyay
Satrajit Adhikari
Somrita Ray
P2860
P304
P356
10.1063/1.3609247
P407
P577
2011-07-01T00:00:00Z