| /dports/science/libint2/libint-2.7.1/tests/unit/ |
| H A D | c-api.c | 35 double gammap, Px, Py, Pz, PAx, PAy, PAz, PBx, PBy, PBz, AB2; in _compute_eri() local
50 PAx = Px - A[0]; in _compute_eri()
60 erieval->PA_x[0] = PAx; in _compute_eri()
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| /dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/ |
| H A D | integrals.cpp | 180 std::vector<double> A_array(int la, int lb, double PAx, double PBx, double PCx, double zeta) { in A_array() argument
207 …incr=pow(-1.0,i+u)*fj(i,la,lb,PAx,PBx)*fact(i)*pow(PCx,i-2*r-2*u)*pow(4.0*zeta,-r-u)/(fact(r)*fact… in A_array()
229 double PAx=xp-xa; in nuclear_int() local
256 std::vector<double> Ax=A_array(la,lb,PAx,PBx,PCx,zeta); in nuclear_int()
320 const double PAx=Px-Ax; in B_array() local
354 *B_theta(i1,la,lb,PAx,PBx,r1,zetaab) in B_array()
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| H A D | obara-saika.cpp | 705 const double PAx=xp-xa; in nuclear_ints_os() local
869 ints(aind,bind,m) = PAx*ints(aind-Nal,bind,m)-PCx*ints(aind-Nal,bind,m+1); in nuclear_ints_os()
1032 const double PAx=xp-xa; in nuclear_int_pulay_os() local
1200 ints(aind,bind,m) = PAx*ints(aind-Nal,bind,m)-PCx*ints(aind-Nal,bind,m+1); in nuclear_int_pulay_os()
1346 const double PAx=xp-xa; in nuclear_int_ders_os() local
1580 ints(aind,bind,m) = PAx*ints(aind-Nal,bind,m)-PCx*ints(aind-Nal,bind,m+1); in nuclear_int_ders_os()
1582 …xint(aind,bind,m) = PAx*xint(aind-Nal,bind,m)-PCx*xint(aind-Nal,bind,m+1) + ints(aind-Nal,bind,m+1… in nuclear_int_ders_os()
1583 yint(aind,bind,m) = PAx*yint(aind-Nal,bind,m)-PCx*yint(aind-Nal,bind,m+1); in nuclear_int_ders_os()
1584 zint(aind,bind,m) = PAx*zint(aind-Nal,bind,m)-PCx*zint(aind-Nal,bind,m+1); in nuclear_int_ders_os()
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| /dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/ |
| H A D | integrals.cpp | 180 std::vector<double> A_array(int la, int lb, double PAx, double PBx, double PCx, double zeta) { in A_array() argument
207 …incr=pow(-1.0,i+u)*fj(i,la,lb,PAx,PBx)*fact(i)*pow(PCx,i-2*r-2*u)*pow(4.0*zeta,-r-u)/(fact(r)*fact… in A_array()
229 double PAx=xp-xa; in nuclear_int() local
256 std::vector<double> Ax=A_array(la,lb,PAx,PBx,PCx,zeta); in nuclear_int()
320 const double PAx=Px-Ax; in B_array() local
354 *B_theta(i1,la,lb,PAx,PBx,r1,zetaab) in B_array()
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| H A D | obara-saika.cpp | 705 const double PAx=xp-xa; in nuclear_ints_os() local
869 ints(aind,bind,m) = PAx*ints(aind-Nal,bind,m)-PCx*ints(aind-Nal,bind,m+1); in nuclear_ints_os()
1032 const double PAx=xp-xa; in nuclear_int_pulay_os() local
1200 ints(aind,bind,m) = PAx*ints(aind-Nal,bind,m)-PCx*ints(aind-Nal,bind,m+1); in nuclear_int_pulay_os()
1346 const double PAx=xp-xa; in nuclear_int_ders_os() local
1580 ints(aind,bind,m) = PAx*ints(aind-Nal,bind,m)-PCx*ints(aind-Nal,bind,m+1); in nuclear_int_ders_os()
1582 …xint(aind,bind,m) = PAx*xint(aind-Nal,bind,m)-PCx*xint(aind-Nal,bind,m+1) + ints(aind-Nal,bind,m+1… in nuclear_int_ders_os()
1583 yint(aind,bind,m) = PAx*yint(aind-Nal,bind,m)-PCx*yint(aind-Nal,bind,m+1); in nuclear_int_ders_os()
1584 zint(aind,bind,m) = PAx*zint(aind-Nal,bind,m)-PCx*zint(aind-Nal,bind,m+1); in nuclear_int_ders_os()
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| /dports/science/libint2/libint-2.7.1/doc/progman/ |
| H A D | lstusecpp.cc | 48 const double PAx = Px - A[0]; in compute_eri() local
58 erieval.PA_x[0] = PAx; in compute_eri()
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| /dports/science/libint2/libint-2.7.1/src/bin/test_eri/ |
| H A D | prep_libint2.h | 123 const double PAx = Px - A[0]; variable
131 erieval->PA_x[v] = PAx;
448 const double PAx = Px - A[0]; variable
460 erieval->PA_x[v] = PAx;
822 const double PAx = Px - A[0]; variable
834 erieval->PA_x[v] = PAx;
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| H A D | eri.h | 137 const LIBINT2_REF_REALTYPE PAx = Px - A[0]; in eri() local
211 tmp *= pow(PAx, l1 - i); in eri()
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| /dports/science/dynare/dynare-4.6.4/matlab/gsa/ |
| H A D | gsa_plotmatrix.m | 77 [H,AX,BigA,P,PAx]=plotmatrix(x(:,jcol));
|
| /dports/science/libint2/libint-2.7.1/export/fortran/ |
| H A D | test-eri.cc | 49 double PAx = Px - A[0]; in compute_eri_c() local
60 erieval[p0123].PA_x[0] = PAx; in compute_eri_c()
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| /dports/science/bagel/bagel-1.2.2/src/integral/libint/ |
| H A D | libint.cc | 168 const double PAx = Px - A[0]; in Libint() local
192 erieval->PA_x[0] = PAx; in Libint()
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| H A D | glibint.cc | 167 const double PAx = Px - A[0]; in GLibint() local
180 erieval->PA_x[0] = PAx; in GLibint()
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| /dports/science/multiwfn/gMultiwfn-3.4.1-0-14-ge873677/src/ |
| H A D | function.f90 | 2092 PAx=Px-Ax
2125 fjtmp=fj(l,Aix,Bix,PAx,PBx)*tl*fact(l)
2249 PAx=Px-Ax
2294 fjtmp=fj(l,Aix,Bix,PAx,PBx)*tl*fact(l)
2412 PAx=Px-Ax
2433 fjtmp=fj(l,Aix,Bix,PAx,PBx)*tl*fact(l)
2577 PAx=Px-Ax
2608 fjtmp=fj(l,Aix,Bix,PAx,PBx)*tl*fact(l)
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| /dports/science/simint/simint-v0.8/test/ |
| H A D | ValeevRef.cpp | 160 const long double PAx = Px - A[0]; in ValeevRef_eri() local
227 tmp *= powl(PAx, l1 - i); in ValeevRef_eri()
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| /dports/devel/asl/asl-current/include/z8/ |
| H A D | f64xx.inc | 159 PAD7S __z8bit IRQPS,7 ; PAx/PDx Selection
|
| /dports/games/supertux2/SuperTux-v0.6.3-Source/contrib/ |
| H A D | schroedingers-boxes-pr-390.patch | 3568 z@kT+tueAfcvnITsuY`TbzwE&M!AHSW6$CNwR}j>1377O_;g8TK;kV#PAx%v~!Yk6i
|
| /dports/math/giacxcas/giac-1.6.0/doc/fr/ |
| H A D | algo.tex | 14833 $P$), ce qui donne $PAx=Pb=LUx$, puis on r\'esoud $Ly=Pb$
|
| /dports/math/gap/gap-4.11.0/grp/ |
| H A D | clasmax.grp | 1719 …LdHn>n2TWQZ4RO:b","+HXUTYw_FKGSJFZG0U6^OFD-sxqqxbPc\\/TYIrl2h","+IC4MO6xlD*PAx\\p+vRof1\\u@h@0cJZ`…
|
| /dports/devel/godot-tools/godot-demo-projects-8d9d58f112d8/3d/material_testers/backgrounds/ |
| H A D | schelde.hdr | 15186 …�ք��rh�؎���αp�ĥ�bv���������v�������א������~fvm����v���e�����kI>Ao�m�w��wَϖPAx��|t�����ߛẇy�����V…
|
| /dports/security/hashcat-legacy/hashcat-legacy-2.00/salts/ |
| H A D | brute-vbulletin.salt | 436424 PAx
|
| /dports/math/py-heyoka/heyoka.py-0.16.0/doc/notebooks/ |
| H A D | The Maxwell-Boltzmann distribution.ipynb | 175567 "ztQ8R9HwfHdlWfbR2YSkc7p+nq1rY/c/FJ1AREZkVnMv0QlEZCT4PJsMDXeAERmRLVu2/PAx/QYM\\\n",
|
| H A D | tides_spokes.ipynb | 31963 "SxeGDBnChx9+yKFDh+wuR67B6XTicDho1aqV3aVIY93yK2g7BTZ9DfJX2l2NiNcoQItI05lu+PAx\\\n",
|