| /dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/dft/ |
| H A D | fun-wignerc.c | 437 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in wignerc_fourth() local
628 d4fdgagagaga = 0.0; in wignerc_fourth()
758 ds->df0040 += factor*d4fdgagagaga; in wignerc_fourth()
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| H A D | fun-b86.c | 430 real d4fdrbgbgbab , d4fdrbgbabab , d4fdrbababab , d4fdgagagaga ; in becke86_fourth() local
621 …d4fdgagagaga = -3.573218827580544E-4*t[19]*t[7]*t[29]+7.030308043264719E-4*t[6]*t[29]+1.7151450372… in becke86_fourth()
746 ds->df0040 += factor*d4fdgagagaga; in becke86_fourth()
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| H A D | fun-pbex.c | 399 real d4fdrbgbgbab , d4fdrbgbabab , d4fdrbababab , d4fdgagagaga ; in pbex_fourth() local
579 …d4fdgagagaga = 4.6452648283682616E-8*t[1]*t[17]*t[51]/pow(rhoa,9.333333333333334)-1.29241936147162… in pbex_fourth()
704 ds->df0040 += factor*d4fdgagagaga; in pbex_fourth()
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| H A D | fun-wl90c.c | 525 real d4fdrbgbgbab , d4fdrbgbabab , d4fdrbababab , d4fdgagagaga ; in wl90c_fourth() local
947 …d4fdgagagaga = -0.90015*t[12]*t[23]*t[294]*t[5]*pow(grada,4.0)-1.04993496*grada*t[29]*t[164]*t[12]… in wl90c_fourth()
1072 ds->df0040 += factor*d4fdgagagaga; in wl90c_fourth()
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| H A D | fun-pw92ac.c | 1167 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in pw92ac_fourth() local
2793 d4fdgagagaga = 0.0; in pw92ac_fourth()
2923 ds->df0040 += factor*d4fdgagagaga; in pw92ac_fourth()
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| H A D | fun-b97-k.c | 2308 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in b97_k_fourth() local
4990 d4fdgagagaga = -0.03109*t19*(-5.626492800000001*t24*t25+ in b97_k_fourth()
5156 ds->df0040 += factor*d4fdgagagaga; in b97_k_fourth()
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| H A D | fun-b97.c | 2310 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in b97_fourth() local
4991 d4fdgagagaga = -0.03109*t19*(-4.64208*t24*t25+19.231392* in b97_fourth()
5157 ds->df0040 += factor*d4fdgagagaga; in b97_fourth()
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| H A D | fun-b97-d.c | 2344 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in b97_d_fourth() local
5086 d4fdgagagaga = -0.03109*t20*(3.3648096*t25*t26-14.34414336* in b97_d_fourth()
5254 ds->df0040 += factor*d4fdgagagaga; in b97_d_fourth()
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| H A D | fun-b97-2.c | 2315 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in b97_2_fourth() local
5000 d4fdgagagaga = -0.03109*t19*(1.04301888*t24*t25-3.848861568000001* in b97_2_fourth()
5165 ds->df0040 += factor*d4fdgagagaga; in b97_2_fourth()
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| H A D | fun-b97-1.c | 2320 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in b97_1_fourth() local
5008 d4fdgagagaga = -0.03109*t19*(-5.364326400000001*t24*t25+ in b97_1_fourth()
5175 ds->df0040 += factor*d4fdgagagaga; in b97_1_fourth()
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| H A D | fun-1-4.c | 2671 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in f14_fourth() local
5773 d4fdgagagaga = -0.03109*t20*(-1.744324128*t31*t32+16.5824843328* in f14_fourth()
5962 ds->df0040 += factor*d4fdgagagaga; in f14_fourth()
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| H A D | fun-hcth120.c | 2617 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in hcth120_fourth() local
5631 d4fdgagagaga = -0.03109*t19*(0.665856*t30*t31-8.716377600000003* in hcth120_fourth()
5816 ds->df0040 += factor*d4fdgagagaga; in hcth120_fourth()
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| H A D | fun-hcth407.c | 2617 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in hcth407_fourth() local
5633 d4fdgagagaga = -0.03109*t19*(7.699488000000001*t30*t31- in hcth407_fourth()
5818 ds->df0040 += factor*d4fdgagagaga; in hcth407_fourth()
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| H A D | fun-hcth407p.c | 2614 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in hcth407p_fourth() local
5629 d4fdgagagaga = -0.03109*t19*(5.787456*t30*t31-66.5150016* in hcth407p_fourth()
5814 ds->df0040 += factor*d4fdgagagaga; in hcth407p_fourth()
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| H A D | fun-hcth93.c | 2629 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in hcth93_fourth() local
5662 d4fdgagagaga = -0.03109*t19*(0.020491392*t30*t31-2.3284171392* in hcth93_fourth()
5848 ds->df0040 += factor*d4fdgagagaga; in hcth93_fourth()
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| H A D | fun-hcth147.c | 2613 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in hcth147_fourth() local
5629 d4fdgagagaga = -0.03109*t19*(-1.237728*t30*t31+10.0261248* in hcth147_fourth()
5814 ds->df0040 += factor*d4fdgagagaga; in hcth147_fourth()
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| H A D | fun-hcth93m.c | 2615 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in hcth93m_fourth() local
5640 d4fdgagagaga = -0.03109*t19*(0.109069536*t30*t31-6.1682646336* in hcth93m_fourth()
5826 ds->df0040 += factor*d4fdgagagaga; in hcth93m_fourth()
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| H A D | fun-b97-3.c | 3380 d4fdrbababab, d4fdgagagaga, d4fdgagagagb, d4fdgagagaab, d4fdgagagbgb, in b97_3_fourth() local
7852 d4fdgagagaga = - in b97_3_fourth()
8172 ds->df0040 += factor*d4fdgagagaga; in b97_3_fourth()
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