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  • src/Parser/unittests/ParserMpqcUnitTest.cpp

    rfac58f re3c4c5  
    6363static string waterMpqc_CLHF ="% Created by MoleCuilder\n\
    6464mpqc: (\n\
     65\tcheckpoint = no\n\
    6566\tsavestate = no\n\
    6667\tdo_gradient = yes\n\
    … …  
    8687static string waterMpqc_CLKS ="% Created by MoleCuilder\n\
    8788mpqc: (\n\
     89\tcheckpoint = no\n\
    8890\tsavestate = no\n\
    8991\tdo_gradient = yes\n\
    … …  
    110112static string waterMpqc_MBPT2 ="% Created by MoleCuilder\n\
    111113mpqc: (\n\
     114\tcheckpoint = no\n\
    112115\tsavestate = no\n\
    113116\tdo_gradient = yes\n\
    … …  
    138141static string waterMpqc_MBPT2_R12 ="% Created by MoleCuilder\n\
    139142mpqc: (\n\
     143\tcheckpoint = no\n\
    140144\tsavestate = no\n\
    141145\tdo_gradient = yes\n\
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