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Searched refs:EUB (Results 1 – 25 of 152) sorted by relevance

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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwxc/
H A Dnwxc_c_m05.F147 type(nwad_dble)::PB,GBB,TB,FB,EUB,ChiB
196 EUB = 0.0d0
237 EUB = EUA
364 EUEG = P*PotLC - EUA - EUB
650 type(nwad_dble)::PB,GBB,TB,FB,EUB,ChiB
687 EUB = 0.0d0
728 EUB = EUA
806 Call nwxc_dldfcss_p(DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
809 Call nwxc_dldfcss(DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
813 Call nwxc_dldfcss_d2(DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
[all …]
H A Dnwxc_c_m06.F166 type(nwad_dble)::PB,GBB,TB,FB,EUB,ChiB
239 EUB = 0.0d0
281 EUB = EUA
357 Call nwxc_m06css_p(param,Tol_Rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
360 Call nwxc_m06css(param,Tol_Rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
364 Call nwxc_m06css_d2(param,Tol_Rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
367 Call nwxc_m06css_d3(param,Tol_Rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
405 EUEG = P*PotLC - EUA - EUB
H A Dnwxc_c_b95.F127 type(nwad_dble)::PB,GBB,TB,FB,EUB,ChiB
201 EUB = EUA
277 Call nwxc_c_b95ss_p(param,dtol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
280 Call nwxc_c_b95ss(param,dtol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
284 Call nwxc_c_b95ss_d2(param,dtol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
287 Call nwxc_c_b95ss_d3(param,dtol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
325 EUEG = P*PotLC - EUA - EUB
H A Dnwxc_c_vs98.F163 type(nwad_dble)::PB,GBB,TB,FB,EUB,ZB,ChiB
215 EUB = 0.0d0
250 EUB = EUA
324 EUB = 0.0d0
338 Call nwxc_vs98ss_p(tol_rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,ZB,
342 Call nwxc_vs98ss(tol_rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,ZB,
347 Call nwxc_vs98ss_d2(tol_rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,ZB,
351 Call nwxc_vs98ss_d3(tol_rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,ZB,
387 EUEG = P*PotLC - EUA - EUB
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwxc/
H A Dnwxc_c_m05.F147 type(nwad_dble)::PB,GBB,TB,FB,EUB,ChiB
196 EUB = 0.0d0
237 EUB = EUA
364 EUEG = P*PotLC - EUA - EUB
650 type(nwad_dble)::PB,GBB,TB,FB,EUB,ChiB
687 EUB = 0.0d0
728 EUB = EUA
806 Call nwxc_dldfcss_p(DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
809 Call nwxc_dldfcss(DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
813 Call nwxc_dldfcss_d2(DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
[all …]
H A Dnwxc_c_m06.F166 type(nwad_dble)::PB,GBB,TB,FB,EUB,ChiB
239 EUB = 0.0d0
281 EUB = EUA
357 Call nwxc_m06css_p(param,Tol_Rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
360 Call nwxc_m06css(param,Tol_Rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
364 Call nwxc_m06css_d2(param,Tol_Rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
367 Call nwxc_m06css_d3(param,Tol_Rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
405 EUEG = P*PotLC - EUA - EUB
H A Dnwxc_c_b95.F127 type(nwad_dble)::PB,GBB,TB,FB,EUB,ChiB
201 EUB = EUA
277 Call nwxc_c_b95ss_p(param,dtol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
280 Call nwxc_c_b95ss(param,dtol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
284 Call nwxc_c_b95ss_d2(param,dtol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
287 Call nwxc_c_b95ss_d3(param,dtol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
325 EUEG = P*PotLC - EUA - EUB
H A Dnwxc_c_vs98.F163 type(nwad_dble)::PB,GBB,TB,FB,EUB,ZB,ChiB
215 EUB = 0.0d0
250 EUB = EUA
324 EUB = 0.0d0
338 Call nwxc_vs98ss_p(tol_rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,ZB,
342 Call nwxc_vs98ss(tol_rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,ZB,
347 Call nwxc_vs98ss_d2(tol_rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,ZB,
351 Call nwxc_vs98ss_d3(tol_rho,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,ZB,
387 EUEG = P*PotLC - EUA - EUB
/dports/misc/molequeue/molequeue-0.9.0/molequeue/app/certs/
H A DSHA-1 Federal Root CA.cer22 AQcwDwYNYIZIAYb4RQEHFwMBCDAPBg1ghkgBhvhFAQcXAwENMA8GDWCGSAGG+EUB
40 AWUDAgEDAzAbBg1ghkgBhvhFAQcXAwEHBgpghkgBZQMCAQMMMBsGDWCGSAGG+EUB
/dports/misc/py-molequeue/molequeue-0.9.0/molequeue/app/certs/
H A DSHA-1 Federal Root CA.cer22 AQcwDwYNYIZIAYb4RQEHFwMBCDAPBg1ghkgBhvhFAQcXAwENMA8GDWCGSAGG+EUB
40 AWUDAgEDAzAbBg1ghkgBhvhFAQcXAwEHBgpghkgBZQMCAQMMMBsGDWCGSAGG+EUB
/dports/www/chromium-legacy/chromium-88.0.4324.182/third_party/llvm/clang/lib/AST/
H A DStmtOpenMP.cpp267 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
313 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
443 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
488 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
781 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
885 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
930 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
973 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1018 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1062 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/devel/llvm12/llvm-project-12.0.1.src/clang/lib/AST/
H A DStmtOpenMP.cpp267 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
313 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
443 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
488 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
781 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
885 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
930 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
973 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1018 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1062 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/devel/wasi-compiler-rt12/llvm-project-12.0.1.src/clang/lib/AST/
H A DStmtOpenMP.cpp267 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
313 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
443 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
488 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
781 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
885 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
930 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
973 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1018 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1062 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/devel/llvm-devel/llvm-project-f05c95f10fc1d8171071735af8ad3a9e87633120/clang/lib/AST/
H A DStmtOpenMP.cpp354 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
469 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
599 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
644 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
937 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1041 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1086 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1129 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1174 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1218 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/devel/wasi-compiler-rt13/llvm-project-13.0.1.src/clang/lib/AST/
H A DStmtOpenMP.cpp329 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
415 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
545 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
590 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
883 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
987 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1032 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1075 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1120 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1164 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/devel/wasi-libcxx/llvm-project-13.0.1.src/clang/lib/AST/
H A DStmtOpenMP.cpp329 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
415 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
545 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
590 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
883 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
987 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1032 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1075 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1120 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1164 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/lang/rust/rustc-1.58.1-src/src/llvm-project/clang/lib/AST/
H A DStmtOpenMP.cpp329 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
415 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
545 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
590 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
883 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
987 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1032 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1075 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1120 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1164 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/devel/llvm13/llvm-project-13.0.1.src/clang/lib/AST/
H A DStmtOpenMP.cpp329 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
415 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
545 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
590 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
883 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
987 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1032 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1075 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1120 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1164 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/lang/clang-mesa/clang-13.0.1.src/lib/AST/
H A DStmtOpenMP.cpp329 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
415 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
545 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
590 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
883 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
987 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1032 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1075 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1120 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1164 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/science/openbabel/openbabel-3.1.1/test/pdb_ligands_sdf/
H A D5eub_5s7.sdf3 Coordinates from PDB:5EUB:A:303 Model:1 without hydrogens
99 5EUB
/dports/devel/llvm90/llvm-9.0.1.src/tools/clang/lib/AST/
H A DStmtOpenMP.cpp164 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
214 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
377 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
426 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
766 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
908 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
957 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1005 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1079 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1147 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/devel/llvm80/llvm-8.0.1.src/tools/clang/lib/AST/
H A DStmtOpenMP.cpp146 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
196 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
359 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
408 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
748 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
890 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
939 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
987 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1061 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1129 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/devel/llvm70/llvm-7.0.1.src/tools/clang/lib/AST/
H A DStmtOpenMP.cpp146 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
196 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
359 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
408 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
748 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
890 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
939 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
987 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1061 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
1127 Dir->setEnsureUpperBound(Exprs.EUB); in Create()
[all …]
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/nwpwxc/
H A Dnwpwxc_c_m05.F106 double precision PB,GBB,TB,FB,FPB,FGB,FTB,EUB,EUEGB,ChiB,EUPB
174 EUB = EUA
230 Call nwpwxc_m05css(param,DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
251 EUEG = P*PotLC - EUA - EUB
484 double precision PB,GBB,TB,FB,FPB,FGB,FTB,EUB,EUEGB,ChiB,EUPB
540 EUB = EUA
596 Call nwpwxc_dldfcss(DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
617 EUEG = P*PotLC - EUA - EUB
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/nwpwxc/
H A Dnwpwxc_c_m05.F106 double precision PB,GBB,TB,FB,FPB,FGB,FTB,EUB,EUEGB,ChiB,EUPB
174 EUB = EUA
230 Call nwpwxc_m05css(param,DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
251 EUEG = P*PotLC - EUA - EUB
484 double precision PB,GBB,TB,FB,FPB,FGB,FTB,EUB,EUEGB,ChiB,EUPB
540 EUB = EUA
596 Call nwpwxc_dldfcss(DTol,PB,GBB,TB,FB,FPB,FGB,FTB,EUB,
617 EUEG = P*PotLC - EUA - EUB

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