spin multiplet
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Spectroscopic properties of open shell diatomic molecules using Piris natural orbital functionals

2021 ◽  
Vol 23 (4) ◽  
pp. 2953-2963
Author(s):  
Raúl Quintero-Monsebaiz ◽  
Luis Ignacio Perea-Ramírez ◽  
Mario Piris ◽  
Alberto Vela
Keyword(s):  
Diatomic Molecules ◽  
Spectroscopic Properties ◽  
Open Shell ◽  
Second Order ◽  
Order Perturbation ◽  
Natural Orbital ◽  
Pair Model ◽  
Spin Multiplet

Spectroscopic properties of nine heteronuclear diatomic molecules using an interactive pair model (PNOF7s) that has been generalized for spin multiplet states and its second order perturbation variant, NOF-MP2, are reported.

scholarly journals Heavy quark spin multiplet structure of P¯(*)ΣQ(*) molecular states

2018 ◽  
Vol 98 (1) ◽  
Author(s):  
Yuki Shimizu ◽  
Yasuhiro Yamaguchi ◽  
Masayasu Harada
Keyword(s):  
Heavy Quark ◽  
Multiplet Structure ◽  
Quark Spin ◽  
Spin Multiplet

scholarly journals Analytical energy gradient of high-spin multiplet state calculated by the SAC-CI method

2001 ◽  
Vol 350 (3-4) ◽  
pp. 351-358 ◽  
Author(s):  
Mayumi Ishida ◽  
Kazuo Toyota ◽  
Masahiro Ehara ◽  
Hiroshi Nakatsuji
Keyword(s):  
High Spin ◽  
Energy Gradient ◽  
Spin Multiplet

Suppression of the low-spin multiplet components in the3pphotoelectron spectra of atomic and solid3dmetals

2000 ◽  
Vol 62 (5) ◽  
Author(s):  
A. von dem Borne ◽  
R. L. Johnson ◽  
B. Sonntag ◽  
M. Talkenberg ◽  
A. Verweyen ◽  
...  
Keyword(s):  
Spin Multiplet
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