| no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
| 1 |
Analytical Hartree–Fock gradients with respect to the cell parameter for systems periodic in three dimensions
|
Doll, K.
|
|
2004
|
112 |
5-6 |
p. 394-402
|
article
|
| 2 |
A parallelized integral-direct second-order Møller–Plesset perturbation theory method with a fragment molecular orbital scheme
|
Mochizuki, Yuji
|
|
2004
|
112 |
5-6 |
p. 442-452
|
article
|
| 3 |
Approximate formulas for the characteristics of interelectronic angle densities
|
Koga, Toshikatsu
|
|
2004
|
112 |
5-6 |
p. 431-434
|
article
|
| 4 |
Electron localizability indicator for correlated wavefunctions. I. Parallel-spin pairs
|
Kohout, Miroslav
|
|
2004
|
112 |
5-6 |
p. 453-459
|
article
|
| 5 |
Improving numerical integration through basis set expansion
|
McCormack, Dew A.
|
|
2004
|
112 |
5-6 |
p. 410-418
|
article
|
| 6 |
Method of moments of coupled-cluster equations: a new formalism for designing accurate electronic structure methods for ground and excited states
|
Piecuch, P.
|
|
2004
|
112 |
5-6 |
p. 349-393
|
article
|
| 7 |
Multicenter bonding and the structure of electron-rich molecules. Model of three-center four-electron bonding reconsidered
|
Ponec, Robert
|
|
2004
|
112 |
5-6 |
p. 419-430
|
article
|
| 8 |
Relativistic double-zeta, triple-zeta, and quadruple-zeta basis sets for the 5d elements Hf–Hg
|
Dyall, Kenneth G.
|
|
2004
|
112 |
5-6 |
p. 403-409
|
article
|
| 9 |
Subshell-pair interelectronic angles of atoms in momentum space
|
Matsuyama, Hisashi
|
|
2004
|
112 |
5-6 |
p. 435-441
|
article
|
Journal description