Communication: MULTIMODE calculations of low-lying vibrational states of NO3 using an adiabatic potential energy surface

Zahra Homayoon; Joel M. Bowman

doi:10.1063/1.4900734

Communication: MULTIMODE calculations of low-lying vibrational states of NO3 using an adiabatic potential energy surface

The Journal of Chemical Physics ◽

10.1063/1.4900734 ◽

2014 ◽

Vol 141 (16) ◽

pp. 161104 ◽

Cited By ~ 4

Author(s):

Zahra Homayoon ◽

Joel M. Bowman

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Adiabatic Potential ◽

Vibrational States ◽

Adiabatic Potential Energy Surface

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Adsorption and dissociation ofO2at Be(0001): First-principles prediction of an energy barrier on the adiabatic potential energy surface

Physical Review B ◽

10.1103/physrevb.79.165416 ◽

2009 ◽

Vol 79 (16) ◽

Cited By ~ 13

Author(s):

Ping Zhang ◽

Bo Sun ◽

Yu Yang

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

First Principles ◽

Energy Barrier ◽

Energy Surface ◽

Adiabatic Potential ◽

Adiabatic Potential Energy Surface ◽

Adsorption And Dissociation

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Adiabatic potential-energy surface of O2/Al(111): rare entrance-channel barriers but molecularly chemisorbed state apt for abstraction

Solid State Communications ◽

10.1016/s0038-1098(00)00509-3 ◽

2001 ◽

Vol 117 (9) ◽

pp. 531-535 ◽

Cited By ~ 42

Author(s):

Y. Yourdshahyan ◽

B. Razaznejad ◽

B.I. Lundqvist

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Adiabatic Potential ◽

Entrance Channel ◽

Adiabatic Potential Energy Surface

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Adiabatic Potential Energy Surface of the 1,2,3-Trifluorobenzene Cation-Radical

Journal of Structural Chemistry ◽

10.1023/b:jory.0000034799.54040.2f ◽

2003 ◽

Vol 44 (6) ◽

pp. 946-950 ◽

Cited By ~ 1

Author(s):

V. P. Vysotskii ◽

L. N. Shchegoleva

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Cation Radical ◽

Adiabatic Potential ◽

Adiabatic Potential Energy Surface

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Accurate adiabatic potential energy surface for 12A′ state of FH2 based on ab initio data extrapolated to the complete basis set limit

The European Physical Journal D ◽

10.1140/epjd/e2014-50445-3 ◽

2015 ◽

Vol 69 (1) ◽

Cited By ~ 5

Author(s):

Yong-Qing Li ◽

Yu-Zhi Song ◽

António Joaquim de Campos Varandas

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Ab Initio ◽

Energy Surface ◽

Adiabatic Potential ◽

Basis Set ◽

Complete Basis ◽

Complete Basis Set ◽

Adiabatic Potential Energy Surface ◽

Complete Basis Set Limit

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An investigation of the adiabatic potential energy surface of a Pseudo-Jahn-Teller complex using X-ray diffraction

Structural Chemistry ◽

10.1007/bf00671978 ◽

1992 ◽

Vol 3 (1) ◽

pp. 37-52 ◽

Cited By ~ 4

Author(s):

Charles J. Simmons

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Adiabatic Potential ◽

X Ray Diffraction ◽

X Ray ◽

Jahn Teller ◽

Adiabatic Potential Energy Surface

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Femtosecond time-resolved spectroscopic studies of the dynamics of the relaxation of excitons in the lowest adiabatic potential energy surface in NaCl

Journal of Physics Condensed Matter ◽

10.1088/0953-8984/6/24/018 ◽

1994 ◽

Vol 6 (24) ◽

pp. 4581-4600 ◽

Cited By ~ 7

Author(s):

T Makimura ◽

K Tanimura ◽

N Itoh ◽

T Tokizaki ◽

A Nakamura

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Spectroscopic Studies ◽

Adiabatic Potential ◽

Time Resolved ◽

Adiabatic Potential Energy Surface

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Jahn-Teller Effect on the Structure of the Emission Produced by Excitation in theABand of KI: Tl-Type Phosphors. Two Kinds of Minima on theΓ4−(T1u3)Adiabatic Potential-Energy Surface

Physical Review B ◽

10.1103/physrevb.1.4161 ◽

1970 ◽

Vol 1 (10) ◽

pp. 4161-4178 ◽

Cited By ~ 232

Author(s):

Atsuo Fukuda

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Adiabatic Potential ◽

Teller Effect ◽

Jahn Teller ◽

Jahn Teller Effect ◽

Adiabatic Potential Energy Surface

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Accurate global adiabatic potential energy surface for the ground state of AlH2+ by extrapolation to the complete basis set limit

Molecular Physics ◽

10.1080/00268976.2019.1655599 ◽

2019 ◽

Vol 118 (7) ◽

pp. e1655599

Author(s):

S. J. Chai ◽

H. Y. Ma ◽

Y. L. Lü ◽

J. Y. Liu ◽

Y. Q. Li

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Ground State ◽

Energy Surface ◽

Adiabatic Potential ◽

Basis Set ◽

Complete Basis ◽

Complete Basis Set ◽

Adiabatic Potential Energy Surface ◽

Complete Basis Set Limit

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Electron wavepacket dynamics in highly quasi-degenerate coupled electronic states: A theory for chemistry where the notion of adiabatic potential energy surface loses the sense

The Journal of Chemical Physics ◽

10.1063/1.4742155 ◽

2012 ◽

Vol 137 (22) ◽

pp. 22A520 ◽

Cited By ~ 8

Author(s):

Takehiro Yonehara ◽

Kazuo Takatsuka

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Electronic States ◽

Adiabatic Potential ◽

Adiabatic Potential Energy Surface ◽

Wavepacket Dynamics

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Adiabatic potential energy surface of the Jahn-Teller complexes in SrF2:Cr2+ crystal

10.1063/5.0032430 ◽

2020 ◽

Author(s):

M. N. Sarychev ◽

W. A. L. Hosseny ◽

A. S. Bondarevskaya ◽

G. S. Shakurov ◽

V. A. Ulanov ◽

...

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Adiabatic Potential ◽

Jahn Teller ◽

Adiabatic Potential Energy Surface

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