/dports/science/xcfun/xcfun-2.1.1-1-gf87ca0e/src/ |
H A D | xcint.cpp | 103 {"XC_A_GAA_TAUA", 3, XC_DENSITY | XC_GRADIENT | XC_KINETIC}, 105 {"XC_N_GNN_TAUN", 3, XC_DENSITY | XC_GRADIENT | XC_KINETIC}, 107 {"XC_A_B_GAA_GAB_GBB_TAUA_TAUB", 7, XC_DENSITY | XC_GRADIENT | XC_KINETIC}, 109 {"XC_N_S_GNN_GNS_GSS_TAUN_TAUS", 7, XC_DENSITY | XC_GRADIENT | XC_KINETIC}, 112 XC_DENSITY | XC_GRADIENT | XC_LAPLACIAN | XC_KINETIC}, 115 XC_DENSITY | XC_GRADIENT | XC_LAPLACIAN | XC_KINETIC | XC_JP}, 118 XC_DENSITY | XC_GRADIENT | XC_LAPLACIAN | XC_KINETIC}, 123 {"XC_A_AX_AY_AZ_TAUA", 5, XC_DENSITY | XC_GRADIENT | XC_KINETIC}, 126 XC_DENSITY | XC_GRADIENT | XC_KINETIC}, 127 {"XC_N_NX_NY_NZ_TAUN", 5, XC_DENSITY | XC_GRADIENT | XC_KINETIC}, [all …]
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/dports/science/libxc/libxc-5.0.0/src/ |
H A D | gga_k_tflw.c | 66 XC_KINETIC, 82 XC_KINETIC, 98 XC_KINETIC, 114 XC_KINETIC, 130 XC_KINETIC, 146 XC_KINETIC, 162 XC_KINETIC, 226 XC_KINETIC, 242 XC_KINETIC, 258 XC_KINETIC, [all …]
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H A D | gga_k_apbe.c | 76 XC_KINETIC, 92 XC_KINETIC, 108 XC_KINETIC, 124 XC_KINETIC, 140 XC_KINETIC, 156 XC_KINETIC,
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H A D | gga_k_dk.c | 118 XC_KINETIC, 134 XC_KINETIC, 150 XC_KINETIC, 166 XC_KINETIC, 182 XC_KINETIC,
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H A D | gga_k_gds08.c | 31 XC_KINETIC, 60 XC_KINETIC, 89 XC_KINETIC, 118 XC_KINETIC,
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H A D | lda_k_tf.c | 52 XC_KINETIC, 68 XC_KINETIC,
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H A D | gga_k_apbeint.c | 57 XC_KINETIC, 73 XC_KINETIC,
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H A D | gga_k_llp.c | 53 XC_KINETIC, 69 XC_KINETIC,
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H A D | gga_k_mpbe.c | 58 XC_KINETIC, 74 XC_KINETIC,
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H A D | gga_k_exp4.c | 22 XC_KINETIC,
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H A D | lda_k_zlp.c | 27 XC_KINETIC,
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H A D | gga_k_pearson.c | 22 XC_KINETIC,
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H A D | gga_k_meyer.c | 22 XC_KINETIC,
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H A D | gga_k_ol1.c | 22 XC_KINETIC,
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H A D | gga_k_pw86.c | 22 XC_KINETIC,
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H A D | gga_k_thakkar.c | 22 XC_KINETIC,
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H A D | mgga_k_pc07.c | 22 XC_KINETIC,
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/dports/science/xcfun/xcfun-2.1.1-1-gf87ca0e/src/functionals/ |
H A D | brx.cpp | 135 XC_DENSITY | XC_GRADIENT | XC_KINETIC | XC_LAPLACIAN | XC_JP, 142 XC_DENSITY | XC_GRADIENT | XC_KINETIC | XC_LAPLACIAN | XC_JP, 149 XC_DENSITY | XC_GRADIENT | XC_KINETIC | XC_LAPLACIAN | XC_JP,
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H A D | r2SCANc.cpp | 31 XC_DENSITY | XC_GRADIENT | XC_KINETIC,
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H A D | revtpssc.cpp | 32 XC_DENSITY | XC_GRADIENT | XC_KINETIC,
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H A D | SCANc.cpp | 30 XC_DENSITY | XC_GRADIENT | XC_KINETIC,
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H A D | r4SCANc.cpp | 30 XC_DENSITY | XC_GRADIENT | XC_KINETIC,
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H A D | rSCANc.cpp | 31 XC_DENSITY | XC_GRADIENT | XC_KINETIC,
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H A D | rppSCANc.cpp | 30 XC_DENSITY | XC_GRADIENT | XC_KINETIC,
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H A D | tpssc.cpp | 32 XC_DENSITY | XC_GRADIENT | XC_KINETIC,
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