Published March 5, 2020
| Version v1
Software
Open
GPrep
Description
Python package for fitting repulsive potentials in Density Functional Tight Binding theory with Gaussian Process Regression.
Files
gprep-release_v1.0.zip
Files
(4.6 MB)
| Name | Size | Download all |
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md5:91ba9825dcb859cf4869b4b263f62377
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4.6 MB | Preview Download |