Ab Initio Calculation of the Electronic Transition Moments for Excited States of the H2 Molecule

1999 ◽  
Vol 198 (1) ◽  
pp. 52-56 ◽  
Author(s):  
Ikhlas Drira
Keyword(s):  
Ab Initio ◽  
Excited States ◽  
Electronic Transition ◽  
Ab Initio Calculation ◽  
Transition Moments ◽  
H2 Molecule

Ab initio calculation of the ground and first excited states of the lithium dimer

2021 ◽  
Author(s):  
Jianjun Qi ◽  
Yuyao Bai ◽  
Qianqian Guo ◽  
Yong-Chang Han ◽  
Shundalau Maksim
Keyword(s):  
Ab Initio ◽  
Excited States ◽  
Ab Initio Calculation ◽  
Lithium Dimer

Ab-initio calculation of the ground and excited states of MgH using a pseudopotential approach

2009 ◽  
Vol 471 (1-3) ◽  
pp. 22-28 ◽  
Author(s):  
J.-M. Mestdagh ◽  
P. de Pujo ◽  
B. Soep ◽  
F. Spiegelman
Keyword(s):  
Ab Initio ◽  
Excited States ◽  
Ab Initio Calculation ◽  
Pseudopotential Approach

Long-range behavior of the transition dipole moments of heteronuclear dimers XY (X, Y = Li, Na, K, Rb) based on ab initio calculations

2018 ◽  
Vol 20 (3) ◽  
pp. 1889-1896 ◽  
Author(s):  
E. A. Bormotova ◽  
S. V. Kozlov ◽  
E. A. Pazyuk ◽  
A. V. Stolyarov
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Excited States ◽  
Long Range ◽  
Internuclear Distance ◽  
Electronic Transition ◽  
Dipole Moments ◽  
Transition Dipole ◽  
Transition Dipole Moments

The electronic transition dipole moments between the ground and excited states converging to the lowest three dissociation limits of heteronuclear dimers XY (X, Y = Li, Na, K, Rb) were ab initio calculated and asymptotically analyzed at large internuclear distance.

Ab initio calculation on the low-lying excited states of cation including spin–orbit coupling

2013 ◽  
Vol 425 ◽  
pp. 156-161 ◽  
Author(s):  
Yanlei Liu ◽  
Hongsheng Zhai ◽  
Xiaomei Zhang ◽  
Yufang Liu
Keyword(s):  
Ab Initio ◽  
Excited States ◽  
Ab Initio Calculation ◽  
Orbit Coupling ◽  
Spin Orbit Coupling ◽  
Spin Orbit
Sign in / Sign up

Export Citation Format

Share Document