Published May 15, 2018
| Version 2.0.2
Software
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bobbypaton/GoodVibes: GoodVibes v2.0.2
- 1. Colorado State University
- 2. @insilichem, Universitat Autònoma de Barcelona
- 3. ShangHai Hengxing / QianChen Paper Co.Ltd
Description
Calculate quasi-harmonic free energies from Gaussian output files with temperature and haptic corrections
Files
bobbypaton/GoodVibes-2.0.2.zip
Files
(357.7 kB)
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md5:d4cecbdc215eff80ea1e8735be65b3d1
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Additional details
Related works
- Is supplement to
- https://github.com/bobbypaton/GoodVibes/tree/2.0.2 (URL)