II: PROPERTIES OF DIATOMIC AND TRIATOMIC MOLECULES: A theoretical study of the × 6Σ+, A 6Σ+, and 6Δ states of CrH

Molecular Physics

Volumn 101, Issue 1-2, 2003, Pages 87-91

  Roos, B O ^a  

^a Department of Theoretical Chemistry ^*  (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

CHROMIUM COMPOUNDS; ELECTRONS; MOLECULAR DYNAMICS; MOLECULES; PERTURBATION TECHNIQUES;

DIATOMIC MOLECULE; ELECTRONIC STATES; TRIATOMIC MOLECULES;

MOLECULAR PHYSICS;

EID: 1542346823     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970210158731     Document Type: Article

References (15)

1. McLean, A. D., and Yoshimine, M., 1968. IBM J. Res. Dev., 3:206
2. Yoshimine, M., 1969. IBM Corp. Tech. Rep., RJ 555
3. Yoshimine, M., 1973. J. comput. Phys., 11:333
4. Andersson, K., Bernhardsson, A., Blomberg, M. R. A., Boussard, P., Cooper, D. L., Fleig, T., Fülscher, M. P., Karlstöm, G., Lindh, R., Malmqvist, P.-Å., Neogrády, P., Olsen, J., Roos, B. O., Sadlej, A. J., Schimmelpfennig, B., Schütz, M., Seijo, L., Serrano-Andrés, L., Siegbahn, P. E. M., Stålring, J., Thorsteinsson, T., Veryazov, V., Wahlgren, U., and Widmark, P.-O., 2000. Molcas Version 5.0 University of Lund:Chemical Dept. of Theor. Chem., Center.
5. Bauschlicher, C. W., Ram, R. S., Bernath, P. F., Parsons, C. G., and Galehouse, G., 2001. J. chem. Phys., 115:1312
6. Andersson, K., Malmqvist, P.-Å., Roos, B. O., Sadlej, A. J., and Wolinski, K., 1990. J. phys. Chem., 94:5483
7. Andersson, K., Malmqvist, P.-Å., and Roos, B. O., 1992. J. chem. Phys., 96:1218
8. Roos, B. O., Andersson, K., Fülscher, M. P., Malmqvist, P.-Å., Serrano-Andrés, L., Pierloot, K., and Merchán, M., 1996. Adv. chem. Phys., 93:219
9. Finley, J., Malmqvist, P.-Å., Roos, B. O., and Serrano-Andrés, L., 1998. Chem. Phys. Lett., 288:299
10. Pou-Amérigo, R., Merchán, M., Nebot-Gil, I., Widmark, P.-O., and Roos, B. O., 1995. Theoret. Chim. Acta, 92:149
11. Persson, J., and Taylor, P. R., private communication
12. Hess, B. A., 1986. Phys. Rev. A, 33:3742
13. Gagliardi, L., Orlandi, G., Molina, V., Malmqvist, P.-Å., and Roos, B. O., 2002. Phys. Chem. A, in press
14. Moore, C. E., 1952. Natl Bur. Stand. Circ. Natl. Bur. Stand., 467 1949
15. Chen, Y.-M., Clemmer, D. E., and Armentrout, P. B., 1993. J. chem. Phys., 98:4929