Ab initio potential energy curves for the low‐lying electronic states of the argon excimer

1983 ◽  
Vol 79 (12) ◽  
pp. 6145-6149 ◽  
Author(s):  
J. H. Yates ◽  
W. C. Ermler ◽  
N. W. Winter ◽  
P. A. Christiansen ◽  
Y. S. Lee ◽  
...  
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Electronic States ◽  
Potential Energy Curves

Ab initio potential-energy curves for excited electronic states of the molecular ion AsCl+

1997 ◽  
Vol 264 (1-2) ◽  
pp. 134-138
Author(s):  
Gap-Sue Kim ◽  
David M. Hirst
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Electronic States ◽  
Potential Energy Curves ◽  
Excited Electronic States ◽  
Molecular Ion

scholarly journals Accurate ab initio potential energy curves and spectroscopic properties of the low-lying electronic states of OH− and SH− molecular anions

2016 ◽  
Vol 114 (14) ◽  
pp. 2204-2216 ◽  
Author(s):  
Berthelot Said Duvalier Ramlina Vamhindi ◽  
Mama Nsangou
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Electronic States ◽  
Spectroscopic Properties ◽  
Potential Energy Curves ◽  
Molecular Anions

Ab-initio potential energy curves of valence and Rydberg electronic states of the PO radical

2014 ◽  
Vol 1049 ◽  
pp. 102-108 ◽  
Author(s):  
Safia Izzaouihda ◽  
Hassna Abou El Makarim ◽  
Najia Komiha ◽  
Souad Lahmar ◽  
Hassen Ghalila
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Electronic States ◽  
Potential Energy Curves

Potential Energy Curves for the Low-Lying Electronic States of K2+ from ab Initio Calculations with All Electrons Correlated

2017 ◽  
Vol 121 (7) ◽  
pp. 1480-1486 ◽  
Author(s):  
Patrycja Skupin ◽  
Monika Musiał ◽  
Stanisław A. Kucharski
Keyword(s):  
Potential Energy ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Electronic States ◽  
Potential Energy Curves

Ab initio MRCI + Q study on potential energy curves and spectroscopic parameters of low-lying electronic states of CS +

2013 ◽  
Vol 22 (12) ◽  
pp. 123103 ◽  
Author(s):  
Rui Li ◽  
Chang-Li Wei ◽  
Qi-Xiang Sun ◽  
Er-Ping Sun ◽  
Ming-Xing Jin ◽  
...  
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Electronic States ◽  
Potential Energy Curves ◽  
Spectroscopic Parameters

Ab initio transition dipole moments and potential energy curves for the low-lying electronic states of CaH

2017 ◽  
Vol 667 ◽  
pp. 345-350 ◽  
Author(s):  
Alireza Shayesteh ◽  
S. Fatemeh Alavi ◽  
Moloud Rahman ◽  
Ehsan Gharib-Nezhad
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Dipole Moments ◽  
Electronic States ◽  
Potential Energy Curves ◽  
Transition Dipole ◽  
Transition Dipole Moments

MRD-CI calculations on the potential energy curves of the ground and excited electronic states of the noble-gas hydrides, HeH, NeH and ArH

1984 ◽  
Vol 17 (8) ◽  
pp. 1453-1462 ◽  
Author(s):  
G Theodorakopoulos ◽  
S C Farantos ◽  
R J Buenker ◽  
S D Peyerimhoff
Keyword(s):  
Potential Energy ◽  
Noble Gas ◽  
Electronic States ◽  
Potential Energy Curves ◽  
Excited Electronic States ◽  
Ci Calculations

Nonadiabatic wave packet dynamics on the coupled / electronic states of NO2 based on new ab initio potential energy surfaces

2000 ◽  
Vol 259 (2-3) ◽  
pp. 211-226 ◽  
Author(s):  
S. Mahapatra ◽  
H. Köppel ◽  
L.S. Cederbaum ◽  
P. Stampfuß ◽  
W. Wenzel
Keyword(s):  
Potential Energy ◽  
Wave Packet ◽  
Ab Initio ◽  
Potential Energy Surfaces ◽  
Electronic States ◽  
Wave Packet Dynamics ◽  
Energy Surfaces
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