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C-Tools

  • 公開度：3 ★★★
  • ドキュメント充実度：2 ★★☆

This application can produce input files of various applications for density functional theory (DFT) calculations via user-friendly parameter adjustment using three-dimensional computer graphics (3DCG) and graphical user interfaces (GUI). Input-file conversion between different applications is also possible.

基本情報
Last Update:2021/03/05

公式サイト

http://sourceforge.net/projects/c-tools

ライセンス

GPL version 3
利用環境 Windows (Cygwin), MacOS, Linux Qt4 (http://qt-project.org/downloads) and LAPACK are required. Source codes are included in C-TOOLS062.tgz at https://sourceforge.net/projects/c-tools/files/
開発者 Shinji Tsuneyuki (Graduate School of Science, Univ. Tokyo), Yoshihide Yoshimoto (Graduate School of Information Science and Technology, University of Tokyo), Kanako Yoshizawa (The Institute for Solid State Physics, The University of Tokyo), Naoki Watanabe (Mizuho Information and Research Institute)
関連アプリ
関連キーワード
その他 The application’s greatest appeal: The application can read structural data from .cif and .xyz file formats and easily create corresponding DFT code input files. The tool can also convert between DFT code input files.
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