There is a newer version of the record available.

Published March 23, 2022 | Version v1.4.1
Software Open

cyllab/ccinput: v1.4.1

Authors/Creators

  • 1. Université de Sherbrooke

Description

Commits
  • 892fe7a: Fixed xtb command creation when using only raw xyz (Raphaël Robidas)
  • 1373121: Added confirmed specifications for xtb (Raphaël Robidas)
  • b6e1967: Fixed G16 confirmed specifications and alternate specification syntax (Raphaël Robidas)

Files

cyllab/ccinput-v1.4.1.zip

Files (113.1 kB)

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md5:60c951795e6f00fef81aa84defbf509b
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Additional details

Related works

Is supplement to
https://github.com/cyllab/ccinput/tree/v1.4.1 (URL)