검색결과 : 2건
| No. | Article |
|---|---|
| 1 |
Efficient real-space approach to time-dependent density functional theory for the dielectric response of nonmetallic crystals Kootstra F, de Boeij PL, Snijders JG Journal of Chemical Physics, 112(15), 6517, 2000 |
| 2 |
Methods for geometry optimization of large molecules. I. An O(N-2) algorithm for solving systems of linear equations for the transformation of coordinates and forces Farkas O, Schlegel HB Journal of Chemical Physics, 109(17), 7100, 1998 |