Ab initio calculations on the multipole moments and dipole polarisabilities of the PO + molecular ion (X 1 Σ + )

2001 ◽  
Vol 540 (1-3) ◽  
pp. 139-144 ◽  
Author(s):  
P.A. Martin ◽  
M. Fehér
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Multipole Moments ◽  
Molecular Ion ◽  
Dipole Polarisabilities

Theoretical study of laser cooling of TlF+ molecular ion

2020 ◽  
Author(s):  
Wael Chmaisani ◽  
Soumaya Hashem Elmoussaoui
Keyword(s):  
Electronic Structure ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Laser Cooling ◽  
Theoretical Study ◽  
Structure Study ◽  
Molecular Ion

The feasibility of the thallium monofluoride TlF+ molecular ion towards laser cooling is brought into focus throughout an electronic structure study. Ab-initio calculations are carried out to investigate the four...

Millimetre-wave and infrared spectroscopy of Br13 CN: anharmonic force field of cyanogen bromide from spectroscopic data and ab initio calculations

1997 ◽  
Vol 90 (3) ◽  
pp. 495-497
Author(s):  
CLAUDIO ESPOSTI ◽  
FILIPPO TAMASSIA ◽  
CRISTINA PUZZARINI ◽  
RICCARDO TARRONI ◽  
ZDENEK ZELINGER
Keyword(s):  
Infrared Spectroscopy ◽  
Force Field ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Spectroscopic Data ◽  
Cyanogen Bromide ◽  
Millimetre Wave ◽  
Anharmonic Force

Ab Initio Calculations of Defects in CdMnSe Semimagnetic Semiconductors

2020 ◽  
Vol 55 (1) ◽  
pp. 108-113
Author(s):  
M. A. Mehrabova ◽  
H. S. Orujov ◽  
N. H. Hasanov ◽  
A. I. Kazimova ◽  
A. A. Abdullayeva
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Semimagnetic Semiconductors
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