Theoretical study of the electronic structure of KLi molecule: Adiabatic and diabatic potential energy curves and dipole moments

Chemical Physics ◽

10.1016/j.chemphys.2011.07.010 ◽

2012 ◽

Vol 399 ◽

pp. 65-79 ◽

Cited By ~ 15

Author(s):

Riadh Dardouri ◽

Héla Habli ◽

Brahim Oujia ◽

Florent Xavier Gadéa

Keyword(s):

Electronic Structure ◽

Potential Energy ◽

Theoretical Study ◽

Dipole Moments ◽

Potential Energy Curves

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Theoretical study of the CsH molecule: adiabatic and diabatic potential energy curves and dipole moments

Journal of Physics B Atomic Molecular and Optical Physics ◽

10.1088/0953-4075/39/20/c02 ◽

2006 ◽

Vol 39 (20) ◽

pp. 4341-4341

Author(s):

Wissem Zrafi, Brahim Oujia and Flor Gadea

Keyword(s):

Potential Energy ◽

Theoretical Study ◽

Dipole Moments ◽

Potential Energy Curves

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Theoretical study of the LiNa molecule beyond the Born–Oppenheimer approximation: adiabatic and diabatic potential energy curves, radial coupling, adiabatic correction, dipole moments and vibrational levels

Molecular Physics ◽

10.1080/00268976.2019.1605098 ◽

2019 ◽

Vol 118 (3) ◽

pp. e1605098 ◽

Cited By ~ 1

Author(s):

N. Mabrouk ◽

Wissem Zrafi ◽

H. Berriche

Keyword(s):

Potential Energy ◽

Theoretical Study ◽

Dipole Moments ◽

Potential Energy Curves ◽

Vibrational Levels ◽

Oppenheimer Approximation

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Theoretical study of the CsH molecule: adiabatic and diabatic potential energy curves and dipole moments

Journal of Physics B Atomic Molecular and Optical Physics ◽

10.1088/0953-4075/39/18/011 ◽

2006 ◽

Vol 39 (18) ◽

pp. 3815-3832 ◽

Cited By ~ 41

Author(s):

W Zrafi ◽

B Oujia ◽

F X Gadea

Keyword(s):

Potential Energy ◽

Theoretical Study ◽

Dipole Moments ◽

Potential Energy Curves

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Ab initio study of the RbSr electronic structure: Potential energy curves, transition dipole moments, and permanent electric dipole moments

The Journal of Chemical Physics ◽

10.1063/1.4903791 ◽

2014 ◽

Vol 141 (23) ◽

pp. 234309 ◽

Cited By ~ 11

Author(s):

Johann V. Pototschnig ◽

Günter Krois ◽

Florian Lackner ◽

Wolfgang E. Ernst

Keyword(s):

Electronic Structure ◽

Potential Energy ◽

Ab Initio ◽

Electric Dipole ◽

Dipole Moments ◽

Potential Energy Curves ◽

Ab Initio Study ◽

Transition Dipole ◽

Electric Dipole Moments ◽

Transition Dipole Moments

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Theoretical study of low‐lying 1Σ+ and 1Π states of CO. I. Potential energy curves and dipole moments

The Journal of Chemical Physics ◽

10.1063/1.453587 ◽

1987 ◽

Vol 87 (1) ◽

pp. 424-432 ◽

Cited By ~ 99

Author(s):

David L. Cooper ◽

Kate Kirby

Keyword(s):

Potential Energy ◽

Theoretical Study ◽

Dipole Moments ◽

Potential Energy Curves

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Ab initio calculations of electronic structure of the BaCs molecule: adiabatic potential energy curves, spectroscopic constants, spin–orbit effect and permanent and transition electric dipole moments

Theoretical Chemistry Accounts ◽

10.1007/s00214-019-2443-0 ◽

2019 ◽

Vol 138 (4) ◽

Cited By ~ 1

Author(s):

H. Ladjimi ◽

M. Farjallah ◽

R. Mlika ◽

A. R. Allouche ◽

H. Berriche

Keyword(s):

Electronic Structure ◽

Potential Energy ◽

Ab Initio Calculations ◽

Ab Initio ◽

Electric Dipole ◽

Dipole Moments ◽

Potential Energy Curves ◽

Spectroscopic Constants ◽

Spin Orbit ◽

Electric Dipole Moments

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Theoretical study of the NaLi molecule: potential energy curves, spectroscopic constants, dipole moments and radiative lifetimes

Journal of Physics B Atomic Molecular and Optical Physics ◽

10.1088/0953-4075/41/15/155101 ◽

2008 ◽

Vol 41 (15) ◽

pp. 155101 ◽

Cited By ~ 39

Author(s):

N Mabrouk ◽

H Berriche

Keyword(s):

Potential Energy ◽

Theoretical Study ◽

Dipole Moments ◽

Potential Energy Curves ◽

Spectroscopic Constants ◽

Radiative Lifetimes

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Computational notes on the theoretical study on the potential energy curves for X1Σ+, A1П and I1Σ− states of CO molecule

Journal of Molecular Structure THEOCHEM ◽

10.1016/j.theochem.2008.07.003 ◽

2008 ◽

Vol 866 (1-3) ◽

pp. 79-80 ◽

Cited By ~ 1

Author(s):

Guo-liang Xu ◽

Wen-jing Lv ◽

Yu-fang Liu ◽

Zun-lue Zhu ◽

Xian-zhou Zhang ◽

...

Keyword(s):

Potential Energy ◽

Theoretical Study ◽

Potential Energy Curves

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Emerging ground and excited state dipole moments and external electric field effect on electronic structure. A solvatochromism and theoretical study on 2-((phenylimino)methyl)phenol derivatives

Journal of Molecular Liquids ◽

10.1016/j.molliq.2015.01.056 ◽

2015 ◽

Vol 206 ◽

pp. 56-67 ◽

Cited By ~ 15

Author(s):

İsa Sıdır ◽

Yadigar Gülseven Sıdır ◽

Halil Berber ◽

Ferhat Demiray

Keyword(s):

Electronic Structure ◽

Excited State ◽

Electric Field ◽

Field Effect ◽

Theoretical Study ◽

Dipole Moments ◽

Electric Field Effect ◽

Phenol Derivatives ◽

Excited State Dipole Moments ◽

External Electric Field Effect

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Structure and spectroscopic properties of the beryllium hydride ion BeH+: potential energy curves, spectroscopic constants, vibrational levels and permanent dipole moments

The European Physical Journal D ◽

10.1140/epjd/e2013-40141-3 ◽

2013 ◽

Vol 67 (11) ◽

Cited By ~ 13

Author(s):

Mohamed Farjallah ◽

Chedli Ghanmi ◽

Hamid Berriche

Keyword(s):

Potential Energy ◽

Dipole Moments ◽

Spectroscopic Properties ◽

Potential Energy Curves ◽

Spectroscopic Constants ◽

Hydride Ion ◽

Vibrational Levels

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