| /dports/science/libint2/libint-2.7.1/src/bin/libint/ |
| H A D | default_params.cc | 100 CompilationParameters::max_am(std::string t, unsigned int c) const in max_am() function in CompilationParameters
107 auto max_am = (ti != task_params_.end()) ? in max_am() local
154 CompilationParameters::max_am(const std::string& t, unsigned int ma, unsigned int c) in max_am() function in CompilationParameters
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| H A D | default_params.h | 179 static const unsigned int max_am = 1; member
216 std::vector<unsigned int> max_am; member
275 unsigned int max_am() const { in max_am() function
345 const int max_am = (int)max_size.size() - 1u; in extend_max_size() local
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| H A D | iface.cc | 207 const unsigned int max_am = tparams->max_am(); in ~Libint2Iface() local
261 const unsigned int max_am = t->params()->max_am(); in ~Libint2Iface() local
298 const unsigned int max_am = t->params()->max_am(); in ~Libint2Iface() local
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| H A D | buildtest.h | 119 unsigned int max_am = 0; in __BuildTest() local
331 const unsigned int max_am = 10; in BuildTest() local
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| H A D | build_libint.cc | 410 const unsigned int max_am = max(la,lb); in build_onebody_1b_1k() local
972 const unsigned int max_am = max(max(la,lb),max(lc,ld)); in build_TwoPRep_2b_2k() local
1156 const unsigned int max_am = max(max(lc,ld),lbra); in build_TwoPRep_1b_2k() local
1341 const unsigned int max_am = max(lbra,lket); in build_TwoPRep_1b_1k() local
1528 const unsigned int max_am = max(max(la,lb),max(lc,ld)); in build_R12kG12_2b_2k() local
1715 const unsigned int max_am = max(max(la,lb),max(lc,ld)); in build_R12kG12_2b_2k_separate() local
1850 const unsigned int max_am = max(max(la,lb),max(lc,ld)); in build_G12DKH_2b_2k() local
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| H A D | rr.cc | 95 unsigned int max_am = 0; in generate_code() local
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| /dports/science/libecpint/libecpint-1.0.7/src/ |
| H A D | makelist.py | 6 max_am = int(sys.argv[1]) variable
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | libint_wrapper.F | 486 SUBROUTINE cp_libint_init_eri(lib, max_am) argument
488 INTEGER :: max_am local
516 SUBROUTINE cp_libint_init_eri1(lib, max_am) argument
518 INTEGER :: max_am local
528 SUBROUTINE cp_libint_init_3eri(lib, max_am) argument
530 INTEGER :: max_am local
540 SUBROUTINE cp_libint_init_2eri(lib, max_am) argument
542 INTEGER :: max_am local
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| H A D | mp2_optimize_ri_basis.F | 1190 max_am, nexpo_shell, nseta, nsgfa, nsgfa_RI, prog_func, prog_l, RI_max_am, RI_nset, & local
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| H A D | hfx_types.F | 295 INTEGER :: max_am component
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | libint_wrapper.F | 489 SUBROUTINE cp_libint_init_eri(lib, max_am) argument
491 INTEGER :: max_am local
519 SUBROUTINE cp_libint_init_eri1(lib, max_am) argument
521 INTEGER :: max_am local
531 SUBROUTINE cp_libint_init_3eri(lib, max_am) argument
533 INTEGER :: max_am local
543 SUBROUTINE cp_libint_init_2eri(lib, max_am) argument
545 INTEGER :: max_am local
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| H A D | hfx_types.F | 269 INTEGER :: max_am component
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| H A D | mp2_optimize_ri_basis.F | 1190 max_am, nexpo_shell, nseta, nsgfa, nsgfa_RI, prog_func, prog_l, RI_max_am, RI_nset, & local
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| /dports/science/libint2/libint-2.7.1/tests/unit/ |
| H A D | test-c-api.cc | 39 auto max_am = max(max(am1,am2),max(am3,am4)); variable
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| H A D | c-api.c | 132 void init_c_api(unsigned int max_am) { in init_c_api()
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| /dports/science/libint2/libint-2.7.1/src/bin/test_eri/ |
| H A D | time_eri.cc | 96 const int max_am = max(max(am[0],am[1]),max(am[2],am[3])); in main() local
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| H A D | test_eri.cc | 127 const int max_am = max(max(am[0],am[1]),max(am[2],am[3])); in main() local
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| /dports/science/mpqc/mpqc-2.3.1/src/lib/chemistry/qc/basis/ |
| H A D | gaussshell.h | 143 int max_am() const { return max_am_; } in max_am() function
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| /dports/science/libint2/libint-2.7.1/doc/progman/ |
| H A D | lstusecpp.cc | 30 const unsigned int max_am = max(max(am1,am2),max(am3,am4)); in compute_eri() local
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| /dports/science/libint2/libint-2.7.1/export/fortran/ |
| H A D | fortran_example.F90 | 25 INTEGER :: max_am, am1, am2, am3, am4 variable
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| H A D | test-eri.cc | 351 const unsigned int max_am = std::max(std::max(am1,am2),std::max(am3,am4)); in test_eri_c_f() local
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| H A D | libint_f.F90 | 313 INTEGER(KIND=i) :: p1, p2, p3, p4, p1234, am, max_am, am_tot local
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| /dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/ |
| H A D | basis.h | 35 const int max_am=sizeof(shell_types)/sizeof(shell_types[0])-1; variable
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| /dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/ |
| H A D | basis.h | 35 const int max_am=sizeof(shell_types)/sizeof(shell_types[0])-1; variable
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| /dports/science/mpqc/mpqc-2.3.1/src/lib/chemistry/qc/cints/ |
| H A D | int1e.cc | 88 int max_am = max(bs1_->max_angular_momentum(),bs2_->max_angular_momentum()); in Int1eCints() local
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