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/dports/science/jdftx/jdftx-1.6.0/jdftx/electronic/
H A DDumpExcitationsMoments.cpp422 vector3<> ionMoment; in dumpMoment() local
426 ionMoment -= sp->Z * x; in dumpMoment()
433 ionMoment[iDir] = 0.; in dumpMoment()
438 ionMoment = e.gInfo.R * ionMoment; in dumpMoment()
439 vector3<> totalMoment = elecMoment + ionMoment; in dumpMoment()
446 fprintf(fp, "%10s %12.6lf %12.6lf %12.6lf\n", "Ionic", ionMoment[0], ionMoment[1], ionMoment[2]); in dumpMoment()