Theoretical investigation of the eight low-lying electronic states of thecis- andtrans-nitric oxide dimers and its isomerization using multiconfigurational second-order perturbation theory (CASPT2)

R. Sayós; R. Valero; J. M. Anglada; Miguel González

doi:10.1063/1.481234

Theoretical investigation of the eight low-lying electronic states of thecis- andtrans-nitric oxide dimers and its isomerization using multiconfigurational second-order perturbation theory (CASPT2)

The Journal of Chemical Physics ◽

10.1063/1.481234 ◽

2000 ◽

Vol 112 (15) ◽

pp. 6608-6624 ◽

Cited By ~ 55

Author(s):

R. Sayós ◽

R. Valero ◽

J. M. Anglada ◽

Miguel González

Keyword(s):

Nitric Oxide ◽

Perturbation Theory ◽

Theoretical Investigation ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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Cl-Loss and H-Loss Dissociations in Low-Lying Electronic States of the CH3Cl+Ion Studied Using Multiconfiguration Second-Order Perturbation Theory

The Journal of Physical Chemistry A ◽

10.1021/jp050344h ◽

2005 ◽

Vol 109 (19) ◽

pp. 4381-4387 ◽

Cited By ~ 9

Author(s):

Hong-Wei Xi ◽

Ming-Bao Huang ◽

Bo-Zhen Chen ◽

Wen-Zuo Li

Keyword(s):

Perturbation Theory ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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The 12A″, 12A′, and 22A′ electronic states of the H2S+ ion studied using multiconfiguration second-order perturbation theory

Chemical Physics ◽

10.1016/j.chemphys.2005.04.005 ◽

2005 ◽

Vol 315 (1-2) ◽

pp. 133-141 ◽

Cited By ~ 6

Author(s):

Wen-Zuo Li ◽

Ming-Bao Huang

Keyword(s):

Perturbation Theory ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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Electronic states of the ion studied using multiconfiguration second-order perturbation theory

Journal of Molecular Spectroscopy ◽

10.1016/j.jms.2013.10.004 ◽

2014 ◽

Vol 295 ◽

pp. 58-61 ◽

Cited By ~ 2

Author(s):

Shu-Yuan Yu ◽

Cheng-Gen Zhang

Keyword(s):

Perturbation Theory ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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Cl-loss and F-loss dissociations in low-lying electronic states of the CF2Cl2+ ion studied using multiconfiguration second-order perturbation theory

Chemical Physics Letters ◽

10.1016/j.cplett.2009.12.071 ◽

2010 ◽

Vol 485 (4-6) ◽

pp. 290-295

Author(s):

Tao Liu ◽

Wen-Zuo Li ◽

Qing-Zhong Li ◽

Hai-Feng Zhang ◽

Hong-Wei Xi

Keyword(s):

Perturbation Theory ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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Multireference configuration interaction and second-order perturbation theory calculations for the 1 3A″, 1 1A″, and 1 1A′ electronic states of vinylnitrene and vinylphosphinidene

Chemical Physics Letters ◽

10.1016/0009-2614(96)00865-2 ◽

1996 ◽

Vol 260 (1-2) ◽

pp. 7-14 ◽

Cited By ~ 19

Author(s):

Vudhichai Parasuk ◽

Christopher J. Cramer

Keyword(s):

Perturbation Theory ◽

Configuration Interaction ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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C, D, and E Electronic States of the SO2+Ion Studied Using Multiconfiguration Second-Order Perturbation Theory

The Journal of Physical Chemistry A ◽

10.1021/jp048524z ◽

2004 ◽

Vol 108 (33) ◽

pp. 6901-6907 ◽

Cited By ~ 17

Author(s):

Wen-Zuo Li ◽

Ming-Bao Huang

Keyword(s):

Perturbation Theory ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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Electronic states of the ion studied using multiconfiguration second-order perturbation theory

Chemical Physics ◽

10.1016/j.chemphys.2004.07.009 ◽

2004 ◽

Vol 304 (3) ◽

pp. 253-259 ◽

Cited By ~ 3

Author(s):

Wen-Zuo Li ◽

Ming-Bao Huang

Keyword(s):

Perturbation Theory ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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Low-lying electronic states of the OCS+ ion studied using multiconfiguration second-order perturbation theory

Chemical Physics Letters ◽

10.1016/j.cplett.2005.09.040 ◽

2005 ◽

Vol 416 (1-3) ◽

pp. 107-112 ◽

Cited By ~ 4

Author(s):

Bo-Zhen Chen ◽

Ming-Bao Huang ◽

Hai-Bo Chang

Keyword(s):

Perturbation Theory ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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F-Loss and H-Loss Dissociations in Low-Lying Electronic States of the CH3F+Ion Studied Using Multiconfiguration Second-Order Perturbation Theory

The Journal of Physical Chemistry A ◽

10.1021/jp0524835 ◽

2005 ◽

Vol 109 (40) ◽

pp. 9149-9155 ◽

Cited By ~ 5

Author(s):

Hong-Wei Xi ◽

Ming-Bao Huang ◽

Bo-Zhen Chen ◽

Wen-Zuo Li

Keyword(s):

Perturbation Theory ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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Bromine-Loss and Hydrogen-Loss Dissociations in Low-Lying Electronic States of the CH3Br+Ion Studied Using Multiconfiguration Second-Order Perturbation Theory

The Journal of Physical Chemistry A ◽

10.1021/jp056138r ◽

2006 ◽

Vol 110 (26) ◽

pp. 8167-8173 ◽

Cited By ~ 3

Author(s):

Hong-Wei Xi ◽

Ming-Bao Huang

Keyword(s):

Perturbation Theory ◽

Electronic States ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Second Order Perturbation Theory

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