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[ 原始碼: gausssum  ]

套件: gausssum (3.0.1.1-1)

gausssum 的相關超連結

gausssum

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下載原始碼套件 gausssum

維護者:

Original Maintainers:

外部的資源:

  • 主頁 [gausssum.sourceforge.net]

相似套件:

parse and display Gaussian, GAMESS, and etc's output

GaussSum parses the output files of ADF, GAMESS, GAMESS-UK, Gaussian, Jaguar and PC GAMESS calculations to extract useful information.

GaussSum uses GNUPlot to display the progress of geometry optimisations, density of states spectrum, UV-VIS spectra, IR spectra, Raman spectra, and electron density difference maps. It can also display all lines containing an arbitrary phrase and more.

其他與 gausssum 有關的套件

  • 依賴
  • 推薦
  • 建議
  • dep: gnuplot
    Command-line driven interactive plotting program.
    同時作為一個虛擬套件由這些套件提供: gnuplot-nox, gnuplot-qt, gnuplot-x11
  • dep: python3
    interactive high-level object-oriented language (default python3 version)
  • dep: python3-cclib
    Parsers and algorithms for computational chemistry (Python3 module)
  • dep: python3-matplotlib
    Python based plotting system in a style similar to Matlab (Python 3)
  • dep: python3-numpy
    Fast array facility to the Python 3 language
  • dep: python3-tk
    Tkinter - Writing Tk applications with Python 3.x

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