mirror of https://github.com/pfloos/quack
10 lines
208 B
Plaintext
10 lines
208 B
Plaintext
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#! /bin/bash
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cp mol/Hu input/molecule
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cp basis/Hu input/basis
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cp int/ERI.Hu.dat int/ERI.dat
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cp int/Kin.Hu.dat int/Kin.dat
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cp int/Nuc.Hu.dat int/Nuc.dat
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cp int/Ov.Hu.dat int/Ov.dat
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./bin/QuAcK
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