Correlated wave functions for the ground state of the atoms Li through Kr

Chemical Physics Letters

Volumn 428, Issue 4-6, 2006, Pages 241-244

  Buendia E ^a   Galvez F J ^a   Sarsa, A ^b  

^a UNIVERSITY OF GRANADA   (Spain)

^b UNIVERSITY OF CÓRDOBA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; FUNCTION EVALUATION; GROUND STATE; LITHIUM; MATHEMATICAL MODELS; MONTE CARLO METHODS; OPTIMIZATION;

JASTROW CORRELATION FACTOR; PARAMETERIZED OPTIMIZED EFFECTIVE POTENTIAL (POEP); WAVE FUNCTIONS;

WAVE EQUATIONS;

EID: 33748087455     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2006.07.027     Document Type: Article

References (34)

1. Hammond B.L., Lester Jr. W.A., and Reynolds P.J. Monte Carlo Methods in Ab Initio Quantum Chemistry (1994), World Scientific, Singapore
2. Reynolds P., Ceperley D.M., Alder B.J., and Lester Jr. W.A. J. Chem. Phys. 77 (1982) 5593
3. Harrison R.J., and Handy N.C. Chem. Phys. Lett. 113 (1985) 257
4. Schmidt K.E., and Moskowitz J.W. J. Chem. Phys. 93 (1990) 4172
5. Huang C.-J., Umrigar C.J., and Nightingale M.P. J. Chem. Phys. 107 (1997) 3007
6. Langfelder P., Rothstein S.M., and Vrbik J. J. Chem. Phys. 107 (1997) 8525
7. Filippi C., and Fahy S. J. Chem. Phys. 112 (2000) 3523
8. Lin X., Zhang H., and Rappe A.M. J. Chem. Phys. 112 (2000) 2650
9. Gálvez F.J., Buendía E., and Sarsa A. J. Chem. Phys. 115 (2001) 1166
10. Gálvez F.J., Buendía E., and Sarsa A. Chem. Phys. Lett. 387 (2003) 330
11. Umezawa N., Tsuneyuki S., Ohno T., Shiraishi K., and Chikyow T. J. Chem. Phys. 122 (2005) 224101
12. Yoshida T., Mizushima Y., and Igucho K. J. Chem. Phys. 89 (1989) 5815
13. Mitas L. Phys. Rev. A 49 (1994) 4411
14. D.M. Ceperley, L. Mitas, in: I. Prigogine and S.A. Rice, (Eds.), Advances in Chemical Physics, vol. XCIII, 1996, p. 1.
15. Casula M., and Sorella S. J. Chem. Phys. 119 (2003) 6500
16. Ma A., Drummond N.H., Towler M.D., and Needs R.J. Phys. Rev. E 71 (2005) 066704
17. Buendía E., Gálvez F.J., and Sarsa A. J. Chem. Phys. 124 (2006) 154101
18. Caffarel M., Daudey J.P., Heully J.L., and Ramírez-Solís A. J. Chem. Phys. 123 (2005) 094102
19. Boys S.F., and Handy N.C. Proc. R. Soc. London A 310 (1969) 43
20. Moskowitz J.W., and Schmidt K.E. J. Chem. Phys. 97 (1992) 3382
21. Alexander S.A., and Coldwell R.L. J. Chem. Phys. 103 (1995) 2572
22. Alexander S.A., Coldwell R.L., Hoffmeyer R.E., and Thakkar A.J. Theochem-J. Mol. Struct. 388 (1996) 7
23. Sarsa A., Gálvez F.J., and Buendía E. J. Chem. Phys. 109 (1998) 7075
24. Sarsa A., Gálvez F.J., and Buendía E. J. Chem. Phys. 111 (1999) 3319
25. Sarsa A., Gálvez F.J., and Buendía E. J. Phys. B 32 (1999) 2245
26. Gálvez F.J., Buendía E., and Sarsa A. J. Chem. Phys. 110 (1999) 5721
27. Sarsa A., Gálvez F.J., and Buendía E. J. Chem. Phys. 109 (1998) 3346
28. Snajdr M., and Rothstein S.M. J. Chem. Phys. 112 (2000) 4935
29. Sharp R.T., and Horton G.K. Phys. Rev. 90 (1953) 317
30. Talman J.D., and Shadwick W.F. Phys. Rev. A 14 (1976) 36
31. Sarsa A., Gálvez F.J., and Buendía E. J. Phys. B 36 (2003) 4393
32. Sarsa A., Gálvez F.J., and Buendía E. Atom. Data Nucl. Data Tables 88 (2004) 163
33. Chakravorty S.J., Gwaltney S.R., Davidson E.R., Parpia F.A., and Froese Fischer C. Phys. Rev. A 47 (1993) 3649
34. Clementi E., and Hofmann D.W.M. J. Mol. Struct.-Theochem 330 (1995) 17