검색결과 : 7건
| No. | Article |
|---|---|
| 1 |
New Relativistic Atomic Natural Orbital Basis Sets for Lanthanide Atoms with Applications to the Ce Diatom and LuF3 Roos BO, Lindh R, Malmqvist PA, Veryazov V, Widmark PO, Borin AC Journal of Physical Chemistry A, 112(45), 11431, 2008 |
| 2 |
New relativistic ANO basis sets for actinide atoms Roos BO, Lindh R, Malmqvist PA, Veryazov V, Widmark PO Chemical Physics Letters, 409(4-6), 295, 2005 |
| 3 |
New relativistic ANO basis sets for transition metal atoms Roos BO, Lindh R, Malmqvist PA, Veryazov V, Widmark PO Journal of Physical Chemistry A, 109(29), 6575, 2005 |
| 4 |
Main group atoms and dimers studied with a new relativistic ANO basis set Roos BO, Lindh R, Malmqvist PA, Veryazov V, Widmark PO Journal of Physical Chemistry A, 108(15), 2851, 2004 |
| 5 |
Theoretical study of the unusual potential energy curve of the A (1)Sigma(+) state of AgH Witek HA, Fedorov DG, Hirao K, Viel A, Widmark PO Journal of Chemical Physics, 116(19), 8396, 2002 |
| 6 |
The water dimer interaction energy: Convergence to the basis set limit at the correlated level Schutz M, Brdarski S, Widmark PO, Lindh R, Karlstrom G Journal of Chemical Physics, 107(12), 4597, 1997 |
| 7 |
Conformational Properties and Apparent Dissociation-Constants of Titrating Polyelectrolytes - Monte-Carlo Simulation and Scaling Arguments Ullner M, Jonsson B, Widmark PO Journal of Chemical Physics, 100(4), 3365, 1994 |