forked from Lainports/opnsense-ports
Taken from: https://github.com/freebsd/freebsd-ports.git Commit id: 5070672073b68be364139bc6b3a89100bd17d331
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262 B
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5 lines
262 B
Text
Libint is a library for evaluating ERI (electron replusion integral)
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over Cartesian Gaussian fuctions for modern atomic and molecular theory;
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esp. for science/mpqc and science/psi3.
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WWW: http://www.files.chem.vt.edu/chem-dept/valeev/software/libint/libint.html
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