A series of Python3 script to lower the barrier of computing and simulating molecular and material systems.

You can not select more than 25 topics Topics must start with a letter or number, can include dashes ('-') and can be up to 35 characters long.

Tag: Branch: Tree: 05684f9cf6

main

Branches Tags

${ item.name }

Create tag ${ searchTerm }

Create branch ${ searchTerm }

from '05684f9cf6'

${ noResults }

CMMDE/cmmde_gui

History

Aditya Wibawa Sakti 57d8339d20 addition to xTB functions		2 years ago
..
molekul	bug fix opt orca	2 years ago
test	addition to xTB functions	2 years ago
gui.py	addition to xTB functions	2 years ago