/dports/science/nwchem-data/nwchem-7.0.2-release/src/lucia/ |
H A D | ekt.F | 36 SUBROUTINE ZERO_OFFDIAG(A,NDIM,IPACK) argument 67 SUBROUTINE INVERT_BY_DIAG(A,B,SCR,VEC,NDIM) argument 151 SUBROUTINE COPDIA(A,VEC,NDIM,IPACK) argument 173 SUBROUTINE SQRTMT(A,NDIM,ITASK,ASQRT,AMSQRT,SCR) argument 248 SUBROUTINE XDIAXT(XDX,X,DIA,NDIM,SCR) argument 507 SUBROUTINE EKTPERT(F,S,NDIM,NORD,EN,C, argument 810 SUBROUTINE GENPERT(F,S,NDIM,NORD,EN,C,VEC1,VEC2,VEC3) argument
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H A D | lucia_gencc4.F | 62 SUBROUTINE SYM_2DENS(RHO2,NDIM,IMODE) argument 140 SUBROUTINE CLEAN_2DENS(RHO2,NDIM) argument 187 SUBROUTINE MKIR2DENS(IMODE,RHO1,RHO2,NDIM,NSPIN) argument 274 SUBROUTINE PRINT_2DENS(RHO2,NDIM,IMODE,THRSH) argument
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H A D | baserou.F | 1 SUBROUTINE FRMDSCO(ARRAY,NDIM,MBLOCK,IFILE,IMZERO) argument 43 SUBROUTINE SKPRCD2(NDIM,MBLOCK,IFILE) argument 723 SUBROUTINE CHLFC1(AL,NDIM) argument 1231 SUBROUTINE COPVEC(FROM,TO,NDIM) argument 2578 SUBROUTINE ICOPVE(IFROM,ITO,NDIM) argument 3046 SUBROUTINE LTXEBB(L,X,B,NDIM,IB) argument 3116 SUBROUTINE LXEBB(L,X,B,NDIM,IB) argument 6548 SUBROUTINE TRNSPO(A,MATDIM,NDIM) argument 6926 SUBROUTINE VTVTOV(AB,A,B,NDIM) argument 6949 SUBROUTINE WRITVE(VEC,NDIM) argument [all …]
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H A D | lucia_icci0.F | 1 SUBROUTINE CHK_S_FOR_SING2(S,NDIM,NSING,X,SCR,SCR2,THRESG) argument 50 SUBROUTINE CHK_S_FOR_SING(S,NDIM,NSING,X,SCR,SCR2) argument 909 SUBROUTINE DIAG_SYM_MAT(A,X,SCR,NDIM,ISYM) argument
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H A D | lucia_mcscf.F | 2777 SUBROUTINE EIGGMTN_LUCAS(AMAT,NDIM,ARVAL,AIVAL,ARVEC,AIVEC, argument 2891 SUBROUTINE COMMAT(A,B,ACOMB,SCR,NDIM) argument 2927 SUBROUTINE COMMUP(C,A,B,NDIM,SCR,ISKIP0) argument 3002 SUBROUTINE EXPFSK(B,EXPMB,NDIM,SCR) argument 3045 SUBROUTINE CVVTOV(VRIN1,VIIN1,VRIN2,VIIN2,VROUT,VIOUT,NDIM) argument 3070 SUBROUTINE PROJVC(VECIN,X,NDIM,NVEC,VECOUT,IPQ) argument 3101 SUBROUTINE CFORA(C,A,NDIM,SCR) argument 3534 SUBROUTINE GPQ(E,NDIM,GR,GI) argument 3950 SUBROUTINE APRMAT(VECA,VECB,AB,NINBL,NBLK,NDIM) argument
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H A D | diis_simple.F | 1 SUBROUTINE DIIS_SIMPLE(LUEVEC,NVEC,NDIM,C) argument
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H A D | crop_simple.F | 1 SUBROUTINE CROP(NVEC,NVECP,MXNVEC,NDIM,LUE,LUP,A, argument
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/lucia/ |
H A D | ekt.F | 36 SUBROUTINE ZERO_OFFDIAG(A,NDIM,IPACK) argument 67 SUBROUTINE INVERT_BY_DIAG(A,B,SCR,VEC,NDIM) argument 151 SUBROUTINE COPDIA(A,VEC,NDIM,IPACK) argument 173 SUBROUTINE SQRTMT(A,NDIM,ITASK,ASQRT,AMSQRT,SCR) argument 248 SUBROUTINE XDIAXT(XDX,X,DIA,NDIM,SCR) argument 507 SUBROUTINE EKTPERT(F,S,NDIM,NORD,EN,C, argument 810 SUBROUTINE GENPERT(F,S,NDIM,NORD,EN,C,VEC1,VEC2,VEC3) argument
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H A D | lucia_gencc4.F | 62 SUBROUTINE SYM_2DENS(RHO2,NDIM,IMODE) argument 140 SUBROUTINE CLEAN_2DENS(RHO2,NDIM) argument 187 SUBROUTINE MKIR2DENS(IMODE,RHO1,RHO2,NDIM,NSPIN) argument 274 SUBROUTINE PRINT_2DENS(RHO2,NDIM,IMODE,THRSH) argument
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H A D | baserou.F | 1 SUBROUTINE FRMDSCO(ARRAY,NDIM,MBLOCK,IFILE,IMZERO) argument 43 SUBROUTINE SKPRCD2(NDIM,MBLOCK,IFILE) argument 723 SUBROUTINE CHLFC1(AL,NDIM) argument 1231 SUBROUTINE COPVEC(FROM,TO,NDIM) argument 2590 SUBROUTINE ICOPVE(IFROM,ITO,NDIM) argument 3058 SUBROUTINE LTXEBB(L,X,B,NDIM,IB) argument 3128 SUBROUTINE LXEBB(L,X,B,NDIM,IB) argument 6560 SUBROUTINE TRNSPO(A,MATDIM,NDIM) argument 6938 SUBROUTINE VTVTOV(AB,A,B,NDIM) argument 6961 SUBROUTINE WRITVE(VEC,NDIM) argument [all …]
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H A D | lucia_icci0.F | 1 SUBROUTINE CHK_S_FOR_SING2(S,NDIM,NSING,X,SCR,SCR2,THRESG) argument 50 SUBROUTINE CHK_S_FOR_SING(S,NDIM,NSING,X,SCR,SCR2) argument 909 SUBROUTINE DIAG_SYM_MAT(A,X,SCR,NDIM,ISYM) argument
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H A D | lucia_mcscf.F | 2777 SUBROUTINE EIGGMTN_LUCAS(AMAT,NDIM,ARVAL,AIVAL,ARVEC,AIVEC, argument 2891 SUBROUTINE COMMAT(A,B,ACOMB,SCR,NDIM) argument 2927 SUBROUTINE COMMUP(C,A,B,NDIM,SCR,ISKIP0) argument 3002 SUBROUTINE EXPFSK(B,EXPMB,NDIM,SCR) argument 3045 SUBROUTINE CVVTOV(VRIN1,VIIN1,VRIN2,VIIN2,VROUT,VIOUT,NDIM) argument 3070 SUBROUTINE PROJVC(VECIN,X,NDIM,NVEC,VECOUT,IPQ) argument 3101 SUBROUTINE CFORA(C,A,NDIM,SCR) argument 3534 SUBROUTINE GPQ(E,NDIM,GR,GI) argument 3950 SUBROUTINE APRMAT(VECA,VECB,AB,NINBL,NBLK,NDIM) argument
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H A D | diis_simple.F | 1 SUBROUTINE DIIS_SIMPLE(LUEVEC,NVEC,NDIM,C) argument
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H A D | crop_simple.F | 1 SUBROUTINE CROP(NVEC,NVECP,MXNVEC,NDIM,LUE,LUP,A, argument
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/dports/devel/grex/grex-1.3.0/cargo-crates/ndarray-0.15.3/src/dimension/ |
H A D | dimension_trait.rs | 65 const NDIM: Option<usize>; const 393 const NDIM: Option<usize> = Some(0); const 436 const NDIM: Option<usize> = Some(1); const 551 const NDIM: Option<usize> = Some(2); const 707 const NDIM: Option<usize> = Some(3); const 829 const NDIM: Option<usize> = Some($n); const 879 const NDIM: Option<usize> = None; const
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/peigs/src/f77/ |
H A D | types.f | 4 subroutine type1(a,b,alpha,beta,q,e,NIN,NDIM,record) argument 67 subroutine TYPE2 (a,b,alpha,beta,q,e,NIN,NDIM,record) argument 140 subroutine TYPE3 (a,b,alpha,beta,q,e,NIN,NDIM,record) argument 193 subroutine TYPE4 (a,b,alpha,beta,q,e,NIN,NDIM,record) argument 249 subroutine TYPE5 (a,b,alpha,beta,q,e,NIN,NDIM,record) argument
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/peigs/src/f77/ |
H A D | types.f | 4 subroutine type1(a,b,alpha,beta,q,e,NIN,NDIM,record) argument 67 subroutine TYPE2 (a,b,alpha,beta,q,e,NIN,NDIM,record) argument 140 subroutine TYPE3 (a,b,alpha,beta,q,e,NIN,NDIM,record) argument 193 subroutine TYPE4 (a,b,alpha,beta,q,e,NIN,NDIM,record) argument 249 subroutine TYPE5 (a,b,alpha,beta,q,e,NIN,NDIM,record) argument
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/dports/science/dakota/dakota-6.13.0-release-public.src-UI/packages/external/FSUDace/ |
H A D | fsu_cvt_problems.C | 105 # define NDIM 2 in cvt_test01() macro 177 # define NDIM 2 in cvt_test02() macro 250 # define NDIM 2 in cvt_test03() macro 323 # define NDIM 2 in cvt_test04() macro 396 # define NDIM 2 in cvt_test05() macro 469 # define NDIM 2 in cvt_test06() macro 542 # define NDIM 2 in cvt_test07() macro 615 # define NDIM 2 in cvt_test08() macro 688 # define NDIM 3 in cvt_test09() macro 769 # define NDIM 2 in cvt_test10() macro [all …]
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/dports/science/siesta/siesta-4.1.5/Src/ |
H A D | inver.f | 9 SUBROUTINE INVER(A,B,N,NDIM,INFO) argument 12 INTEGER N,NDIM,INFO local
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/dports/science/clhep/2.4.1.0/CLHEP/GenericFunctions/src/ |
H A D | PhaseSpace.cc | 42 PhaseSpace::Component::Component(unsigned int NDIM, bool isMomenta) : c(new Clockwork()) { in Component() 57 PhaseSpace::PhaseSpace(unsigned int NDIM): in PhaseSpace()
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/dports/math/py-deap/deap-1.3.1/examples/de/ |
H A D | basic.py | 27 NDIM = 10 variable
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/dports/math/py-yt/yt-4.0.1/yt/utilities/lib/tests/ |
H A D | test_fill_region.py | 6 NDIM = 32 variable
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/dports/science/smoldyn/smoldyn-2.67/source/NextSubVolume/ |
H A D | Constants.h | 30 const int NDIM = 3; variable
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/dports/science/siconos/siconos-4.4.0/externals/hairer/ |
H A D | decsol.f | 1 SUBROUTINE DEC (N, NDIM, A, IP, IER) argument 68 SUBROUTINE SOL (N, NDIM, A, B, IP) argument 110 SUBROUTINE DECH (N, NDIM, A, LB, IP, IER) argument 181 SUBROUTINE SOLH (N, NDIM, A, LB, B, IP) argument 330 SUBROUTINE SOLC (N, NDIM, AR, AI, BR, BI, IP) argument 393 SUBROUTINE DECHC (N, NDIM, AR, AI, LB, IP, IER) argument 502 SUBROUTINE SOLHC (N, NDIM, AR, AI, LB, BR, BI, IP) argument 658 SUBROUTINE SOLB (N, NDIM, A, ML, MU, B, IP) argument 837 SUBROUTINE SOLBC (N, NDIM, AR, AI, ML, MU, BR, BI, IP) argument
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/vib/ |
H A D | vib_transp.F | 1 SUBROUTINE vib_TRANSP(A,NDIM,N) argument
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