Calculation of the electron-nucleus scalar-pseudoscalar interaction constant WS for YbF and BaF molecules: A perturbative approach

Physical Review A - Atomic, Molecular, and Optical Physics

Volumn 78, Issue 1, 2008, Pages

  Nayak, Malaya K ^a   Chaudhuri, Rajat K ^b  

^a BHABHA ATOMIC RESEARCH CENTRE   (India)

^b INDIAN INSTITUTE OF ASTROPHYSICS   (India)

Author keywords

[No Author keywords available]

Indexed keywords

CONVERGENCE OF NUMERICAL METHODS; FLOW INTERACTIONS;

ACTIVE ORBITALS; AMERICAN PHYSICAL SOCIETY (APS); CONVERGENCE BEHAVIORS; MANY BODY PERTURBATION THEORY (MBPT); PERTURBATIVE APPROACH; PERTURBATIVE CALCULATIONS; SECOND ORDERS;

PERTURBATION TECHNIQUES;

EID: 47749096014     PISSN: 10502947     EISSN: 10941622     Source Type: Journal    
DOI: 10.1103/PhysRevA.78.012506     Document Type: Article

References (23)

1. A. V. Titov, N. S. Mosyagin, T. A. Isaev, and D. DeMille, Prog. Theor. Chem. Phys. PTCPBG 1567-7354 10.1007/1-4020-4528-X_12 15, 253 (2006).
2. E. D. Commins, Adv. At., Mol., Opt. Phys. AAMPE9 1049-250X 40, 1 (1999).
3. W. Bernreuther and M. Suzuki, Rev. Mod. Phys. RMPHAT 0034-6861 10.1103/RevModPhys.63.313 63, 313 (1991).
4. A. V. Titov, N. S. Mosyagin, and V. F. Ezhov, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.77.5346 77, 5346 (1996).
5. F. A. Parpia, J. Phys. B JPAPEH 0953-4075 10.1088/0953-4075/31/7/008 31, 1409 (1998).
6. H. M. Quiney, H. Skaane, and I. P. Grant, J. Phys. B JPAPEH 0953-4075 10.1088/0953-4075/31/3/003 31, L85 (1998).
7. M. G. Kozlov, A. V. Titov, N. S. Mosyagin, and P. V. Souchkov, Phys. Rev. A PLRAAN 1050-2947 10.1103/PhysRevA.56.R3326 56, R3326 (1997).
8. M. K. Nayak, R. K. Chaudhuri, and B. P. Das, Phys. Rev. A PLRAAN 1050-2947 10.1103/PhysRevA.75.022510 75, 022510 (2007).
9. M. K. Nayak and R. K. Chaudhuri, J. Phys. B JPAPEH 0953-4075 80, 012051 (2007).
10. N. C. Handy and H. F. Schaefer III, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.447489 81, 5031 (1984).
11. Y. Yamaguchim, Y. Osamura, J. D. Goddard, and H. F. Schaefer III, in A New Dimension in Quantum Chemistry: Analytic Derivative Methods in Ab-initio Molecular Electronic Structure Theory (Oxford University Press, New York, 1994).
12. J. Almlöf and P. R. Taylor, Int. J. Quantum Chem. IJQCB2 0020-7608 10.1002/qua.560270610 27, 743 (1985).
13. R. P. Feynmann, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.56.340 56, 340 (1939).
14. H. D. Cohen and C. C. J. Roothan, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1701512 43, S34 (1965).
15. E. R. Davidson, Reduced Density Matrix in Quantum Chemistry (Academic Press, New York, 1976), Vol. 4.
16. M. K. Nayak and R. K. Chaudhuri, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/j.cplett.2005.11.065 419, 191 (2006).
17. M. G. Kozlov, J. Phys. B JPAPEH 0953-4075 10.1088/0953-4075/30/18/003 30, L607 (1997).
18. M. G. Kozlov and V. F. Ezhov, Phys. Rev. A PLRAAN 1050-2947 10.1103/PhysRevA.49.4502 49, 4502 (1994).
19. K. P. Huber and G. Herzberg, Molecular Spectra and Molecular Structure: Constants of Diatomic Molecules (Van Nostrand, New York, 1979), Vol. 4.
20. M. K. Nayak and R. K. Chaudhuri, J. Phys. B JPAPEH 0953-4075 10.1088/0953-4075/39/5/020 39, 1231 (2006).
21. M. G. Kozlov and L. N. Labzowsky, J. Phys. B JPAPEH 0953-4075 10.1088/0953-4075/28/10/008 28, 1933 (1995).
22. L. B. Knight, W. C. Easley, and W. Weltner, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1674610 54, 322 (1971).
23. See http://dirac.chem.sdu.dk/obtain/Dirac-site-license.shtml: Dirac, a relativistic ab-initio electronic structure program, Release DIARC04 (2004), written by H. J. Aa. Jensen, T. Saue, and L. Visscher with contributions from V. Bakken, E. Eliav, T. Enevoldsen, T. Fleig, O. Fossgaard, T. Helgaker, J. Laerdahl, C. V. Larsen, P. Norman, J. Olsen, M. Pernpointner, J. K. Pedersen, K. Ruud, P. Salek, J. N. P. Van Stralen, J. Thyssen, O. Visser, and T. Winther (http://dirac.chem.sdu.dk).