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Searched refs:factoryT (Results 1 – 25 of 36) sorted by relevance

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/dports/science/madness/madness-ebb3fd7/src/madness/mra/
H A Dtestdiff3D.cc12 typedef FunctionFactory<double,3> factoryT; typedef
122 functionT u = factoryT(world).f( u_exact ); in main()
123 functionT dudxe = factoryT(world).f(dudx_exact ); in main()
124 functionT dudye = factoryT(world).f(dudy_exact ); in main()
125 functionT dudze = factoryT(world).f(dudz_exact ); in main()
127 functionT xleft_d = factoryT(world).f( xleft_dirichlet) ; in main()
128 functionT xright_d = factoryT(world).f(xright_dirichlet) ; in main()
129 functionT xleft_n = factoryT(world).f( xleft_neumann ) ; in main()
130 functionT xright_n = factoryT(world).f(xright_neumann ) ; in main()
132 functionT yleft_d = factoryT(world).f( yleft_dirichlet) ; in main()
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H A Dtestdiff2D.cc12 typedef FunctionFactory<double,2> factoryT; typedef
102 functionT u = factoryT(world).f( u_exact ); in main()
103 functionT dudxe = factoryT(world).f(dudx_exact ); in main()
104 functionT dudye = factoryT(world).f(dudy_exact ); in main()
106 functionT xleft_d = factoryT(world).f( xleft_dirichlet) ; in main()
107 functionT xright_d = factoryT(world).f(xright_dirichlet) ; in main()
108 functionT xleft_n = factoryT(world).f( xleft_neumann ) ; in main()
109 functionT xright_n = factoryT(world).f(xright_neumann ) ; in main()
111 functionT yleft_d = factoryT(world).f( yleft_dirichlet) ; in main()
112 functionT yright_d = factoryT(world).f(yright_dirichlet) ; in main()
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H A Dtestdiff1D.cc10 typedef FunctionFactory<double,1> factoryT; typedef
83 functionT u = factoryT(world).f( u_exact ); in main()
84 functionT due = factoryT(world).f(du_exact ); in main()
86 functionT left_d = factoryT(world).f( left_dirichlet) ; in main()
87 functionT right_d = factoryT(world).f(right_dirichlet) ; in main()
88 functionT left_n = factoryT(world).f( left_neumann ) ; in main()
89 functionT right_n = factoryT(world).f(right_neumann ) ; in main()
H A Dtestdiff1Db.cc11 typedef FunctionFactory<double,1> factoryT; typedef
93 functionT u = factoryT(world).f( u_exact ); in main()
94 functionT due = factoryT(world).f(du_exact ); in main()
96 functionT left_d = factoryT(world).f( left_dirichlet) ; in main()
97 functionT right_d = factoryT(world).f(right_dirichlet) ; in main()
98 functionT left_n = factoryT(world).f( left_neumann ) ; in main()
99 functionT right_n = factoryT(world).f(right_neumann ) ; in main()
H A Dtestpdiff.cc47 typedef FunctionFactory<double,NDIM> factoryT; typedef
97 functionT f = factoryT(world).f(func); in main()
H A Dtestbc.cc53 typedef FunctionFactory<double,3> factoryT; typedef
152 functionT spha = factoryT(world).functor(functorT(new Sphere(coordT(0.0), 1.0, sigma))); in main()
153 functionT sphb = factoryT(world).functor(functorT(new Sphere(coordT(0.0), 3.0, sigma))); in main()
H A Dmraplot.cc382 typedef FunctionFactory<T,NDIM> factoryT; in doplot1() typedef
384 Function<T,NDIM> pFunc = factoryT(world).functor(functorT( in doplot1()
/dports/science/madness/madness-ebb3fd7/src/apps/tdse/
H A Dtdse4.cc71 typedef FunctionFactory<double,4> factoryT; typedef
384 functionT test = factoryT(world).f(fred); test.truncate(); in testbsh()
385 functionT rhs = (mu*mu)*test - functionT(factoryT(world).f(delsqfred)); in testbsh()
403 functionT zero = factoryT(world); in converge()
619 functionT x = factoryT(world).f(xdipole); in propagate()
620 functionT y = factoryT(world).f(ydipole); in propagate()
621 functionT z = factoryT(world).f(zdipole); in propagate()
622 functionT R = factoryT(world).f(bond_length); in propagate()
740 functionT potn = factoryT(world).f(Vn); potn.truncate(); in doit()
742 functionT pote = factoryT(world).f(Ve); pote.truncate(); in doit()
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H A Dtdse.cc213 typedef FunctionFactory<double,3> factoryT; typedef
749 functionT potn = factoryT(world).f(V); potn.truncate(param.thresh); in propagate()
768 functionT dpotn_dx = factoryT(world).f(dVdx); dpotn_dx.truncate(param.thresh); in propagate()
776 functionT x = factoryT(world).f(xdipole); in propagate()
777 functionT y = factoryT(world).f(ydipole); in propagate()
778 functionT z = factoryT(world).f(zdipole); in propagate()
939 functionT potn = factoryT(world).f(V); potn.truncate(); in doit()
959 functionT psi1s = factoryT(world).f(guess1s); in doit()
971 functionT psi2s = factoryT(world).f(guess2s); in doit()
991 functionT y = factoryT(world).f(ydipole); in doit()
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H A Dtdse.confused.cc207 typedef FunctionFactory<double,3> factoryT; typedef
691 functionT potn = factoryT(world).f(V); potn.truncate(); in propagate()
692 functionT dpotn_dx = factoryT(world).f(dVdx); in propagate()
693 functionT dpotn_dy = factoryT(world).f(dVdy); in propagate()
694 functionT dpotn_dz = factoryT(world).f(dVdz); in propagate()
700 functionT x = factoryT(world).f(xdipole); in propagate()
701 functionT y = factoryT(world).f(ydipole); in propagate()
702 functionT z = factoryT(world).f(zdipole); in propagate()
863 functionT potn = factoryT(world).f(V); potn.truncate(); in doit()
883 functionT psi = factoryT(world).f(guess); in doit()
/dports/science/madness/madness-ebb3fd7/src/examples/
H A Dcsqrt.cc44 typedef FunctionFactory<std::complex<double>,1> factoryT; typedef
79 cfunctionT boring = factoryT(world).f(f); in main()
H A Dtdse_example.cc58 typedef FunctionFactory<double,3> factoryT; typedef
233 functionT zdip = factoryT(world).f(zdipole); in propagate()
300 functionT psi = factoryT(world).f(guess); in main()
301 functionT potn = factoryT(world).f(V); in main()
H A Dheat.cc69 typedef FunctionFactory<double,3> factoryT; typedef
115 functionT u0 = factoryT(world).f(uinitial); in main()
H A Dgraveyard47 typedef FunctionFactory<double,3> factoryT;
151 functionT rho = factoryT(world).functor(functorT(new Test()));
164 rho = functionT(factoryT(world).functor(functorT(new Test())));
357 typedef FunctionFactory<double,3> factoryT;
401 functionT rho = factoryT(world).functor(functorT(new MolecularDensityFunctor(molecule)));
631 typedef FunctionFactory<double,3> factoryT;
664 …v[i] = functionT(factoryT(world).functor(functorT(RandomGaussian<double,3>(cell,100.0))).fence(fal…
686 …v[i] = functionT(factoryT(world).functor(functorT(RandomGaussian<double,3>(cell,1000.0))).fence(fa…
H A Dhefxc.cc40 typedef FunctionFactory<double,3> factoryT; typedef
H A Dhedft.cc41 typedef FunctionFactory<double,3> factoryT; typedef
H A Dh2dft.cc39 typedef FunctionFactory<double,3> factoryT; typedef
/dports/science/madness/madness-ebb3fd7/src/apps/nick/
H A Dtdse1.cc192 typedef FunctionFactory<double,NDIM> factoryT; typedef
633 functionT potn = factoryT(world).f(V); potn.truncate(); in propagate()
634 functionT dpotn_dx = factoryT(world).f(dVdx); in propagate()
635 functionT dpotn_dy = factoryT(world).f(dVdy); in propagate()
636 functionT dpotn_dz = factoryT(world).f(dVdz); in propagate()
642 functionT x = factoryT(world).f(xdipole); in propagate()
643 functionT y = factoryT(world).f(ydipole); in propagate()
644 functionT z = factoryT(world).f(zdipole); in propagate()
770 functionT potn = factoryT(world).f(Vsc); potn.truncate(); in doit()
H A Dwavef.h73 typedef FunctionFactory<double,NDIM> factoryT; typedef
/dports/science/madness/madness-ebb3fd7/src/apps/polar/
H A Dmcpfit.cc53 typedef FunctionFactory<double,3> factoryT; typedef
418 mask = functionT(factoryT(world).f(mask3).initial_level(4).norefine()); in set_protocol()
522 functionT rho_c = factoryT(world); in make_reference()
548 …functionT nc_over_r = factoryT(world).functor(functorT(new NcOverR(2*ncore, smoothing_parameter(2*… in make_reference()
593 … functionT core = factoryT(world).functor(functorT(new CoreOrbitalFunctor(corepot, atn, c, m))); in make_reference()
620 …u1 = functionT(factoryT(world).functor(functorT(new PotentialBasisFunctor(cp.n[i], cp.alpha[i], cp… in project_potential_basis()
632 …functionT umcp = factoryT(world).functor(functorT(new CorePotentialFunctor(cp))).thresh(FunctionDe… in make_Upsi()
687 functionT rf = factoryT(world).functor(functorT(new RadiusFunctor())); in calc_optimal_coeffs()
762 functionT rf = factoryT(world).functor(functorT(new RadiusFunctor())); in compute_residuals()
H A Dmoldft.cc150 typedef FunctionFactory<double,3> factoryT; typedef
2019 functionT rho = factoryT(world); in make_density()
2041 functionT rho = factoryT(world); in make_density()
4390 functionT rho = factoryT(world); in make_density_ground()
4414 functionT drho = factoryT(world); in make_derivative_density()
4434 functionT dJ = factoryT(world); in calc_derivative_Jmo()
4435 functionT dJmo = factoryT(world); in calc_derivative_Jmo()
4436 functionT j = factoryT(world); in calc_derivative_Jmo()
4456 functionT dKmo = factoryT(world); in calc_exchange_function()
4457 functionT k1 = factoryT(world); in calc_exchange_function()
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H A Ddesktop152 typedef FunctionFactory<double,3> factoryT;
1950 functionT rho = factoryT(world);
1972 functionT rho = factoryT(world);
4659 functionT rhs = factoryT(world);
4672 brho = factoryT(world);
4782 functionT dJ = factoryT(world);
4785 functionT j1 = factoryT(world);
4786 functionT j2 = factoryT(world);
4805 functionT k1 = factoryT(world);
4806 functionT k2 = factoryT(world);
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/dports/science/madness/madness-ebb3fd7/src/apps/moldft/
H A Dmcpfit.cc53 typedef FunctionFactory<double,3> factoryT; typedef
419 mask = functionT(factoryT(world).f(mask3).initial_level(4).norefine()); in set_protocol()
523 functionT rho_c = factoryT(world); in make_reference()
549 …functionT nc_over_r = factoryT(world).functor(functorT(new NcOverR(2*ncore, smoothing_parameter(2*… in make_reference()
594 … functionT core = factoryT(world).functor(functorT(new CoreOrbitalFunctor(corepot, atn, c, m))); in make_reference()
621 …u1 = functionT(factoryT(world).functor(functorT(new PotentialBasisFunctor(cp.n[i], cp.alpha[i], cp… in project_potential_basis()
633 …functionT umcp = factoryT(world).functor(functorT(new CorePotentialFunctor(cp))).thresh(FunctionDe… in make_Upsi()
688 functionT rf = factoryT(world).functor(functorT(new RadiusFunctor())); in calc_optimal_coeffs()
763 functionT rf = factoryT(world).functor(functorT(new RadiusFunctor())); in compute_residuals()
/dports/science/madness/madness-ebb3fd7/src/apps/chem/
H A DSCF.cc552 functionT fdip = factoryT(world).functor( in localize_boys()
922 factoryT(world).functor( in initial_guess()
1186 functionT rho = factoryT(world); in make_density()
1207 functionT rho = factoryT(world); in make_density()
1494 functionT fdip = factoryT(world).functor( in dipole_matrix_elements()
1529 functionT dipolefunc = factoryT(world) in dipole()
3047 functionT rho = factoryT(world); in make_density_ground()
3070 functionT drho = factoryT(world); in make_derivative_density()
3090 functionT dKmo = factoryT(world); in calc_exchange_function()
3095 functionT k1 = factoryT(world); in calc_exchange_function()
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H A DSCF.h74 typedef FunctionFactory<double,3> factoryT; typedef
285 _f = factoryT(world).functor(functorT(new DipoleFunctor(2))); in VextCosFunctor()
390 mask = functionT(factoryT(world).f(mask3).initial_level(4).norefine()); in set_protocol()

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