/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwxc/ |
H A D | nwxc_x_tpss03.F | 66 Subroutine nwxc_x_tpss03_p(tol_rho, ipol, nq, wght, argument 73 Subroutine nwxc_x_tpss03_d2(tol_rho, ipol, nq, wght, argument 178 Subroutine nwxc_x_tpss03_cs_p(facttwo, tol_rho, ipol, nq, wght, argument 185 Subroutine nwxc_x_tpss03_cs_d2(facttwo, tol_rho, ipol, nq, wght, argument
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H A D | nwxc_c_perdew81.F | 31 Subroutine nwxc_c_perdew81_p(tol_rho, ipol, nq, wght, rho, argument 38 Subroutine nwxc_c_perdew81_d2(tol_rho, ipol, nq, wght, rho, argument
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H A D | nwxc_c_pw91lda.F | 31 Subroutine nwxc_c_pw91lda_p(tol_rho, ipol, nq, wght, rho, argument 38 Subroutine nwxc_c_pw91lda_d2(tol_rho, ipol, nq, wght, rho, argument
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H A D | nwxc_c_perdew86.F | 44 Subroutine nwxc_c_perdew86_p(tol_rho, ipol, nq, wght, rho, rgamma, argument 51 Subroutine nwxc_c_perdew86_d2(tol_rho, ipol, nq, wght, argument
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H A D | nwxc_c_p91_vwn5.F | 52 Subroutine nwxc_c_p91_vwn5_p(tol_rho, ipol, nq, wght, rho, rgamma, argument 59 Subroutine nwxc_c_p91_vwn5_d2(tol_rho, ipol, nq, wght, rho, argument
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwxc/ |
H A D | nwxc_x_tpss03.F | 66 Subroutine nwxc_x_tpss03_p(tol_rho, ipol, nq, wght, argument 73 Subroutine nwxc_x_tpss03_d2(tol_rho, ipol, nq, wght, argument 178 Subroutine nwxc_x_tpss03_cs_p(facttwo, tol_rho, ipol, nq, wght, argument 185 Subroutine nwxc_x_tpss03_cs_d2(facttwo, tol_rho, ipol, nq, wght, argument
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H A D | nwxc_x_m06.F | 56 Subroutine nwxc_x_m06_p(param, tol_rho, ipol, nq, wght, rho, argument 63 Subroutine nwxc_x_m06_d2(param, tol_rho, ipol, nq, wght, rho, argument 559 Subroutine nwxc_x_m06_2x_p(param, tol_rho, ipol, nq, wght, argument 566 Subroutine nwxc_x_m06_2x_d2(param, tol_rho, ipol, nq, wght, argument
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H A D | nwxc_x_m11.F | 33 Subroutine nwxc_x_m08_p(param, tol_rho, ipol, nq, wght, rho, argument 40 Subroutine nwxc_x_m08_d2(param, tol_rho, ipol, nq, wght, rho, argument 980 Subroutine nwxc_x_m11_p(param, tol_rho, ipol, nq, wght, rho, argument 987 Subroutine nwxc_x_m11_d2(param, tol_rho, ipol, nq, wght, rho, argument
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H A D | nwxc_x_m05.F | 66 Subroutine nwxc_x_m05_p(param, tol_rho, ipol, nq, wght, rho, argument 73 Subroutine nwxc_x_m05_d2(param, tol_rho, ipol, nq, wght, rho, argument 518 Subroutine nwxc_x_dldf_p(tol_rho, ipol, nq, wght, rho, rgamma, argument 525 Subroutine nwxc_x_dldf_d2(tol_rho, ipol, nq, wght, rho, rgamma, argument
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H A D | nwxc_c_perdew81.F | 31 Subroutine nwxc_c_perdew81_p(tol_rho, ipol, nq, wght, rho, argument 38 Subroutine nwxc_c_perdew81_d2(tol_rho, ipol, nq, wght, rho, argument
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H A D | nwxc_c_pw91lda.F | 31 Subroutine nwxc_c_pw91lda_p(tol_rho, ipol, nq, wght, rho, argument 38 Subroutine nwxc_c_pw91lda_d2(tol_rho, ipol, nq, wght, rho, argument
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/dports/science/teem/teem-1.11.0-src/src/limn/ |
H A D | splineEval.c | 97 _limnSplineWeightsFind_Linear(double *wght, limnSpline *spline, double f) { in _limnSplineWeightsFind_Linear() 123 _limnSplineWeightsFind_CubicBezier(double *wght, in _limnSplineWeightsFind_CubicBezier() 145 _limnSplineWeightsFind_BC(double *wght, limnSpline *spline, double f) { in _limnSplineWeightsFind_BC() 214 int ii, double *wght) { in _limnSplineFinish_Unknown() 227 int ii, double *wght) { in _limnSplineFinish_Scalar() 240 int ii, double *wght) { in _limnSplineFinish_2Vec() 255 int ii, double *wght) { in _limnSplineFinish_3Vec() 272 int ii, double *wght) { in _limnSplineFinish_Normal() 284 int ii, double *wght) { in _limnSplineFinish_4Vec() 306 int ii, double *wght) { in _limnSplineFinish_Quaternion() [all …]
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/lucia/ |
H A D | numint.F | 2 subroutine gl_weights(xa,xb,npnts,xrts,wght) argument 83 subroutine s_weights(xa,xb,npnts,xrts,wght) argument 148 subroutine test_quad(xa,xb,npnts,xrts,wght) argument
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/lucia/ |
H A D | numint.F | 2 subroutine gl_weights(xa,xb,npnts,xrts,wght) argument 83 subroutine s_weights(xa,xb,npnts,xrts,wght) argument 148 subroutine test_quad(xa,xb,npnts,xrts,wght) argument
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwxc/maxima/f77/ |
H A D | nwxcm_x_camrpbe.F | 101 subroutine nwxcm_x_camrpbe(param,tol_rho,ipol,nq,wght, rho, argument 550 subroutine nwxcm_x_camrpbe_d2(param,tol_rho,ipol,nq,wght, rho, argument 1552 subroutine nwxcm_x_camrpbe_d3(param,tol_rho,ipol,nq,wght, rho, argument
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H A D | nwxcm_c_mpbe.F | 80 subroutine nwxcm_c_mpbe(param,tol_rho,ipol,nq,wght, rho,rgamma, argument 458 subroutine nwxcm_c_mpbe_d2(param,tol_rho,ipol,nq,wght, rho, argument 1368 subroutine nwxcm_c_mpbe_d3(param,tol_rho,ipol,nq,wght, rho, argument
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H A D | nwxcm_c_pbe.F | 81 subroutine nwxcm_c_pbe(param,tol_rho,ipol,nq,wght, rho,rgamma, argument 464 subroutine nwxcm_c_pbe_d2(param,tol_rho,ipol,nq,wght, rho, argument 1416 subroutine nwxcm_c_pbe_d3(param,tol_rho,ipol,nq,wght, rho, argument
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwxc/maxima/f77/ |
H A D | nwxcm_c_pkzb99.F | 59 subroutine nwxcm_c_pkzb99(param,tol_rho,ipol,nq,wght, rho, argument 596 subroutine nwxcm_c_pkzb99_d2(param,tol_rho,ipol,nq,wght, rho, argument 1730 subroutine nwxcm_c_pkzb99_d3(param,tol_rho,ipol,nq,wght, rho, argument
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H A D | nwxcm_x_camrpbe.F | 101 subroutine nwxcm_x_camrpbe(param,tol_rho,ipol,nq,wght, rho, argument 550 subroutine nwxcm_x_camrpbe_d2(param,tol_rho,ipol,nq,wght, rho, argument 1552 subroutine nwxcm_x_camrpbe_d3(param,tol_rho,ipol,nq,wght, rho, argument
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H A D | nwxcm_c_mpbe.F | 80 subroutine nwxcm_c_mpbe(param,tol_rho,ipol,nq,wght, rho,rgamma, argument 458 subroutine nwxcm_c_mpbe_d2(param,tol_rho,ipol,nq,wght, rho, argument 1368 subroutine nwxcm_c_mpbe_d3(param,tol_rho,ipol,nq,wght, rho, argument
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H A D | nwxcm_c_pbe.F | 81 subroutine nwxcm_c_pbe(param,tol_rho,ipol,nq,wght, rho,rgamma, argument 464 subroutine nwxcm_c_pbe_d2(param,tol_rho,ipol,nq,wght, rho, argument 1416 subroutine nwxcm_c_pbe_d3(param,tol_rho,ipol,nq,wght, rho, argument
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H A D | nwxcm_c_ft97.F | 42 subroutine nwxcm_c_ft97(param,tol_rho,ipol,nq,wght, argument 140 subroutine nwxcm_c_ft97_d3(param,tol_rho,ipol,nq,wght, argument
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/nwpwxc/ |
H A D | nwpwxc_x_tpss03.F | 49 Subroutine nwpwxc_x_tpss03(tol_rho, ipol, nq, wght, argument 109 Subroutine nwpwxc_x_tpss03_cs(facttwo, tol_rho, ipol, nq, wght, argument
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/nwpwxc/ |
H A D | nwpwxc_x_tpss03.F | 49 Subroutine nwpwxc_x_tpss03(tol_rho, ipol, nq, wght, argument 109 Subroutine nwpwxc_x_tpss03_cs(facttwo, tol_rho, ipol, nq, wght, argument
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/dports/science/getdp/getdp-3.4.0-source/Kernel/ |
H A D | Gauss_Quadrangle.cpp | 15 double *u, double *v, double *w, double *wght) in Gauss_Quadrangle() 35 double *u, double *v, double *w, double *wght) in GaussLegendre_Quadrangle() 72 double *u, double *v, double *w, double *wght) in GaussSingularR_Quadrangle()
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