PASTA: Python algorithms for searching transition stAtes

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Computer Physics Communications 2018 / 7

PASTA: Python algorithms for searching transition stAtes

Kundu, Sudipta, Bhattacharjee, Satadeep, Lee, Seung-Cheol, Jain, Manish
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Language:
english
Journal:
Computer Physics Communications
DOI:
10.1016/j.cpc.2018.06.026
Date:
July, 2018
File:
PDF, 1.51 MB
english, 2018
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