Molecular dynamics simulations of liquid 4-4 alloys

Material type: 文書・図像類

Author: 正木, 匡彦ほか

Publisher: 宇宙航空研究開発機構

Publication date: 2005-03-31

Material Format: Digital

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Note (General)：: The partial structure factors of liquid Ge-Sn and Ge-Si are important for the modeling of diffusion phenomena in these liquid alloys. These partial st...

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Material Type: 文書・図像類
Title: Molecular dynamics simulations of liquid 4-4 alloys
Author/Editor: 正木, 匡彦
伊丹, 俊夫
Masaki, Tadahiko
Itami, Toshio
Author Heading: 正木, 匡彦
伊丹, 俊夫
Masaki, Tadahiko
Itami, Toshio
Publication, Distribution, etc.: 宇宙航空研究開発機構
Publication Date: 2005-03-31
Publication Date (W3CDTF): 2005-03-31
Alternative Title: 分子動力学計算による液体4-4族合金のシミュレーション
Periodical title: 宇宙航空研究開発機構研究開発報告 = JAXA Research and Development Report: Modeling and Precise Experiments of Diffusion Phenomena in Melts Under Microgravity
No. or year of volume/issue: JAXA-RR-04-044E
Volume: JAXA-RR-04-044E
Pages: 35-38
ISSN (Periodical Title): ISSN : 1349-1113
Text Language Code: eng
Subject Heading: 液体合金
微小重力
数値シミュレーション
原子間ポテンシャル
分子ダイナミクス
Ge-Si合金
分布関数
ポテンシャルエネルギー
liquid alloy
microgravity
numerical simulation
interatomic potential
molecular dynamics
Ge-Si alloy
distribution function
potential energy
Target Audience: 一般
Note (General): The partial structure factors of liquid Ge-Sn and Ge-Si are important for the modeling of diffusion phenomena in these liquid alloys. These partial structure factors were calculated by using two kinds of molecular dynamic simulations, ab initio molecular dynamics simulation and classical molecular dynamics simulation with the Stellinger-Weber interatomic potential. Total structure factors obtained from these molecular dynamics simulations and neutron scattering experiments are in good agreement with each other.
資料番号: AA0048709002
レポート番号: JAXA-RR-04-044E
Source: https://jaxa.repo.nii.ac.jp/?action=repository_action_common_download&item_id=2328&item_no=1&attribute_id=31&file_no=1
https://jaxa.repo.nii.ac.jp/?action=repository_action_common_download&item_id=2328&item_no=1&attribute_id=31&file_no=1
Access Restrictions: 限定公開
Data Provider (Database): 国立情報学研究所 : 学術機関リポジトリデータベース（IRDB）（機関リポジトリ）
https://irdb.nii.ac.jp
Original Data Provider (Database): 宇宙航空研究開発機構 : 宇宙航空研究開発機構リポジトリ