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[DDTP] Please help translation of mpqc package.
- From: Ippei Tamura <ippei1@xxxxxxxxxxxx>
- Subject: [DDTP] Please help translation of mpqc package.
- Date: Sun, 7 Jul 2002 06:14:05 +0900
- Organization: DDTP ja team coordinator
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# Package(s): mpqc
# Package priority: optional
Description: The Massively Parallel Quantum Chemistry Program
MPQC computes the properties of molecules through ab-initio methods. It can
compute closed shell and general restricted open shell Hartree-Fock energies
and gradients, density functional theory energies and gradients, second order
open shell perturbation theory (OPT2[2]) and Z-averaged perturbation theory
(ZAPT2) energies, and second order closed shell Moeller-Plesset perturbation
theory energies and gradients. It also includes an internal coordinate
geometry optimizer.
.
MPQC is build upon the Scientific Computing Toolkit (SC).
Description-ja: 大è¦æ¨¡ãªä¸¦åˆ—é‡å化å¦ãƒ—ãƒã‚°ãƒ©ãƒ
MPQC (Massively Parallel Quantum Chemistry Program) ã¯ã€ab-initio 手法を
使ã£ã¦åˆ†åã®ç‰¹æ€§ã‚’計算ã—ã¾ã™ã€‚
<trans>
.
MPQC 㯠Scientific Computing Toolkit (SC) 上ã«æ§‹ç¯‰ã•ã‚Œã¦ã„ã¾ã™ã€‚
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--
ç”°æ‘ ä¸€å¹³ <ippei1@xxxxxxxxxxxx>
Debian Description Translation Project [DDTP]
日本語ãƒãƒ¼ãƒ コーディãƒãƒ¼ã‚¿
http://www.debian.or.jp/devel/doc/Description-ja.html
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