タイトル | Investigations on the usefulness of the Massively Parallel Processor for study of electronic properties of atomic and condensed matter systems |
本文(外部サイト) | http://hdl.handle.net/2060/19880008875 |
著者(英) | Das, T. P. |
著者所属(英) | State Univ. of New York |
発行日 | 1988-01-01 |
言語 | eng |
内容記述 | The usefulness of the Massively Parallel Processor (MPP) for investigation of electronic structures and hyperfine properties of atomic and condensed matter systems was explored. The major effort was directed towards the preparation of algorithms for parallelization of the computational procedure being used on serial computers for electronic structure calculations in condensed matter systems. Detailed descriptions of investigations and results are reported, including MPP adaptation of self-consistent charge extended Hueckel (SCCEH) procedure, MPP adaptation of the first-principles Hartree-Fock cluster procedure for electronic structures of large molecules and solid state systems, and MPP adaptation of the many-body procedure for atomic systems. |
NASA分類 | COMPUTER OPERATIONS AND HARDWARE |
レポートNO | 88N18259 NASA-CR-182514 NAS 1.26:182514 |
権利 | No Copyright |
URI | https://repository.exst.jaxa.jp/dspace/handle/a-is/147080 |