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GitHub topics: gaussian09

polyluxus/tools-for-g09.bash

Various bash scripts to aid the use of the quantum chemistry software package Gaussian 09.

Language: Shell - Size: 4.11 MB - Last synced at: 17 days ago - Pushed at: about 6 years ago - Stars: 15 - Forks: 3

jkelowitt/Rotapy

Make Gaussian 09 input files for the Rotamers of a given compound.

Language: Python - Size: 543 KB - Last synced at: 11 months ago - Pushed at: almost 4 years ago - Stars: 1 - Forks: 1

CTM-ITODYS/ircbyhand

Fortran script for IRC using Freq calculation provide by Gaussian16

Language: Fortran - Size: 528 KB - Last synced at: 9 months ago - Pushed at: over 2 years ago - Stars: 1 - Forks: 0