| /dports/science/qbox/qbox-public-rel1_73_3/util/kpgen/ |
| H A D | kpgen.cpp | 31 const int shmax=2; variable
38 for ( int i0 = -shmax; i0 <= shmax; i0++ ) in equals()
39 for ( int i1 = -shmax; i1 <= shmax; i1++ ) in equals()
40 for ( int i2 = -shmax; i2 <= shmax; i2++ ) in equals()
58 for ( int i0 = -shmax; i0 <= shmax; i0++ ) in in_BZ()
59 for ( int i1 = -shmax; i1 <= shmax; i1++ ) in in_BZ()
60 for ( int i2 = -shmax; i2 <= shmax; i2++ ) in in_BZ()
133 for ( int ii = -shmax; ii <= shmax; ii++ ) in main()
134 for ( int jj = -shmax; jj <= shmax; jj++ ) in main()
135 for ( int kk = -shmax; kk <= shmax; kk++ ) in main()
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/mp2_grad/ |
| H A D | mp2_memory.F | 44 integer nshpairlocal,nshpair,batch_size,shmax
100 $ nbfpair,nbfpairlocal,shmax,
114 max2e = max(max2e,min(50*shmax**4,21**4)) ! Enuf room for 1 cartesian H shell
159 $ shmax**2*batch_size*nbf +
160 $ max(shmax**2*32**2+3*max2e+mem2,2*nva*shmax**2+nbf**2)
162 $ min(nbf**2,shmax**2*ga_nnodes())*batch_size*nva / ga_nnodes()
206 ma_6 = ma_1a + ma_6a + 2*max(nbf*nbf, nbf*shmax*shmax) + nbf**2
215 ma_7 = ma_1 + ma_6a + shmax*shmax*nbf*batch_size +
216 $ shmax*shmax*nbf + batch_size*nbf + 12*lengd + shmax**4 +
|
| H A D | mp2_back_transform.F | 58 integer junk, ninseg, ierr, i, j, ish, ishlo, ishhi, shmax, tdim
107 $ nbfpair, nbfpairlocal, shmax,
114 tdim = max(nbf*nbf, nbf*shmax*shmax)
193 tdim = shmax*shmax*nbf*ninseg
197 tdim = shmax*shmax*nbf
235 if (.not. ma_push_get(mt_dbl,shmax**4,'pdm buffer',
237 $ ('mp2:backt could not allocate pdm',shmax*4, MA_ERR)
538 $ nbfpair, nbfpairlocal, shmax,
553 integer shmax ! [output] Max AO shell dimension
596 shmax = 0
[all …]
|
| /dports/science/nwchem-data/nwchem-7.0.2-release/src/mp2_grad/ |
| H A D | mp2_memory.F | 44 integer nshpairlocal,nshpair,batch_size,shmax
100 $ nbfpair,nbfpairlocal,shmax,
114 max2e = max(max2e,min(50*shmax**4,21**4)) ! Enuf room for 1 cartesian H shell
159 $ shmax**2*batch_size*nbf +
160 $ max(shmax**2*32**2+3*max2e+mem2,2*nva*shmax**2+nbf**2)
162 $ min(nbf**2,shmax**2*ga_nnodes())*batch_size*nva / ga_nnodes()
206 ma_6 = ma_1a + ma_6a + 2*max(nbf*nbf, nbf*shmax*shmax) + nbf**2
215 ma_7 = ma_1 + ma_6a + shmax*shmax*nbf*batch_size +
216 $ shmax*shmax*nbf + batch_size*nbf + 12*lengd + shmax**4 +
|
| H A D | mp2_back_transform.F | 58 integer junk, ninseg, ierr, i, j, ish, ishlo, ishhi, shmax, tdim
107 $ nbfpair, nbfpairlocal, shmax,
114 tdim = max(nbf*nbf, nbf*shmax*shmax)
193 tdim = shmax*shmax*nbf*ninseg
197 tdim = shmax*shmax*nbf
235 if (.not. ma_push_get(mt_dbl,shmax**4,'pdm buffer',
237 $ ('mp2:backt could not allocate pdm',shmax*4, MA_ERR)
538 $ nbfpair, nbfpairlocal, shmax,
553 integer shmax ! [output] Max AO shell dimension
596 shmax = 0
[all …]
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwdft/coulomb/ |
| H A D | dft_fitvc.F | 44 double precision THRESHOLD,CD_coef_max,shmax,
97 shmax = 0.D0
100 shmax = max(abs(CD_coef(i,imat)), shmax)
103 Dbl_MB((icd_shell-1)+ishp) = shmax
104 CD_coef_max = max(shmax, CD_coef_max)
|
| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwdft/coulomb/ |
| H A D | dft_fitvc.F | 44 double precision THRESHOLD,CD_coef_max,shmax,
95 shmax = 0.D0
98 shmax = max(abs(CD_coef(i,imat)), shmax)
101 Dbl_MB((icd_shell-1)+ishp) = shmax
102 CD_coef_max = max(shmax, CD_coef_max)
|
| /dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/ |
| H A D | fix_template_superquadric.cpp | 288 double shmax = atof(arg[iarg+3]); in FixTemplateSuperquadric() local
289 if(shmax < shmin) in FixTemplateSuperquadric()
294 pdf_shapex->set_params<RANDOM_UNIFORM>(shmin,shmax); in FixTemplateSuperquadric()
296 pdf_shapey->set_params<RANDOM_UNIFORM>(shmin,shmax); in FixTemplateSuperquadric()
298 pdf_shapez->set_params<RANDOM_UNIFORM>(shmin,shmax); in FixTemplateSuperquadric()
336 double shmax = atof(arg[iarg+3]); in FixTemplateSuperquadric() local
337 if(shmax < shmin) in FixTemplateSuperquadric()
341 pdf_size->set_params<RANDOM_UNIFORM>(shmin,shmax); in FixTemplateSuperquadric()
|
| /dports/devel/aarch64-none-elf-gcc/gcc-8.4.0/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1723 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1731 shmask = lshift <= shmax; in _mm_sll_epi16()
1742 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1749 shmask = lshift < shmax; in _mm_sll_epi32()
1761 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1765 shmask = lshift < shmax; in _mm_sll_epi64()
1822 shmask = rshift <= shmax; in _mm_srl_epi16()
1833 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1841 shmask = rshift < shmax; in _mm_srl_epi32()
1853 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/llvm-devel/llvm-project-f05c95f10fc1d8171071735af8ad3a9e87633120/clang/lib/Headers/ppc_wrappers/ |
| H A D | emmintrin.h | 1706 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1714 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1726 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1733 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1746 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1750 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1807 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1819 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1827 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1840 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/lang/gcc12-devel/gcc-12-20211205/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1740 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1748 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1760 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1767 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1780 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1784 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1841 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1853 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1861 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1874 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/lang/gcc9/gcc-9.4.0/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1744 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1752 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1764 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1771 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1784 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1788 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1845 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1857 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1865 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1878 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/wasi-libcxx/llvm-project-13.0.1.src/clang/lib/Headers/ppc_wrappers/ |
| H A D | emmintrin.h | 1706 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1714 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1726 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1733 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1746 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1750 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1807 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1819 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1827 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1840 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/llvm12/llvm-project-12.0.1.src/clang/lib/Headers/ppc_wrappers/ |
| H A D | emmintrin.h | 1706 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1714 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1726 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1733 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1746 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1750 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1807 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1819 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1827 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1840 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/riscv64-gcc/gcc-8.3.0/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1723 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1731 shmask = lshift <= shmax; in _mm_sll_epi16()
1742 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1749 shmask = lshift < shmax; in _mm_sll_epi32()
1761 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1765 shmask = lshift < shmax; in _mm_sll_epi64()
1822 shmask = rshift <= shmax; in _mm_srl_epi16()
1833 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1841 shmask = rshift < shmax; in _mm_srl_epi32()
1853 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/avr-gcc/gcc-10.2.0/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1744 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1752 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1764 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1771 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1784 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1788 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1845 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1857 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1865 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1878 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/lang/gcc11-devel/gcc-11-20211009/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1744 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1752 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1764 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1771 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1784 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1788 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1845 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1857 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1865 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1878 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/lang/gcc10-devel/gcc-10-20211008/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1744 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1752 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1764 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1771 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1784 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1788 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1845 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1857 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1865 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1878 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/llvm-cheri/llvm-project-37c49ff00e3eadce5d8703fdc4497f28458c64a8/clang/lib/Headers/ppc_wrappers/ |
| H A D | emmintrin.h | 1706 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1714 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1726 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1733 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1746 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1750 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1807 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1819 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1827 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1840 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/riscv32-unknown-elf-gcc/gcc-8.4.0/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1723 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1731 shmask = lshift <= shmax; in _mm_sll_epi16()
1742 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1749 shmask = lshift < shmax; in _mm_sll_epi32()
1761 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1765 shmask = lshift < shmax; in _mm_sll_epi64()
1822 shmask = rshift <= shmax; in _mm_srl_epi16()
1833 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1841 shmask = rshift < shmax; in _mm_srl_epi32()
1853 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/arm-none-eabi-gcc/gcc-8.4.0/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1723 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1731 shmask = lshift <= shmax; in _mm_sll_epi16()
1742 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1749 shmask = lshift < shmax; in _mm_sll_epi32()
1761 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1765 shmask = lshift < shmax; in _mm_sll_epi64()
1822 shmask = rshift <= shmax; in _mm_srl_epi16()
1833 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1841 shmask = rshift < shmax; in _mm_srl_epi32()
1853 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/llvm10/llvm-10.0.1.src/tools/clang/lib/Headers/ppc_wrappers/ |
| H A D | emmintrin.h | 1706 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1714 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1726 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1733 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1746 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1750 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1807 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1819 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1827 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1840 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/llvm11/llvm-11.0.1.src/tools/clang/lib/Headers/ppc_wrappers/ |
| H A D | emmintrin.h | 1706 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1714 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1726 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1733 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1746 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1750 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1807 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1819 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1827 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1840 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/devel/riscv64-none-elf-gcc/gcc-8.4.0/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1723 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1731 shmask = lshift <= shmax; in _mm_sll_epi16()
1742 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1749 shmask = lshift < shmax; in _mm_sll_epi32()
1761 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1765 shmask = lshift < shmax; in _mm_sll_epi64()
1822 shmask = rshift <= shmax; in _mm_srl_epi16()
1833 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1841 shmask = rshift < shmax; in _mm_srl_epi32()
1853 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|
| /dports/lang/gcc9-aux/gcc-9.1.0/gcc/config/rs6000/ |
| H A D | emmintrin.h | 1744 const __v8hu shmax = { 15, 15, 15, 15, 15, 15, 15, 15 }; in _mm_sll_epi16() local
1752 shmask = vec_cmple (lshift, shmax); in _mm_sll_epi16()
1764 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_sll_epi32() local
1771 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi32()
1784 const __v2du shmax = { 64, 64 }; in _mm_sll_epi64() local
1788 shmask = vec_cmplt (lshift, shmax); in _mm_sll_epi64()
1845 shmask = vec_cmple (rshift, shmax); in _mm_srl_epi16()
1857 const __v4su shmax = { 32, 32, 32, 32 }; in _mm_srl_epi32() local
1865 shmask = vec_cmplt (rshift, shmax); in _mm_srl_epi32()
1878 const __v2du shmax = { 64, 64 }; in _mm_srl_epi64() local
[all …]
|