Johannes M Dieterich 2faf2ce076 new port: science/xtb ... xtb is a semiempirical extended tight-binding program package with application in computational chemistry and matrials science. Port is configured to use OpenBLAS to facilitate performance. WWW: https://github.com/grimme-lab/xtb		2020-05-28 22:05:42 +00:00
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