/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/symmetry/ |
H A D | sym_nwc.F | 24 subroutine sym_nwc(geom,rtdb,nata,oprint,scale,threquiv,nops) argument 77 LResult = MA_Push_Get(MT_Byte,nata*(nops+1)*16,'scratch labels', 79 LResult = MA_Push_Get(MT_Dbl,nata*(nops+1)*3,'scratch atoms', 81 Lresult = MA_Push_Get(MT_Int,nata,'distinct atoms',ldatom,idatom) 87 $ tags(1,geom),nata, 88 & itype,Byte_MB(iatags),Dbl_MB(icoord),nareal,nata*(nops+1), 141 call sym_put_in_geom(geom, nata, nareal,
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H A D | dosymops.F | 24 subroutine dosymops(symops,nops,coords,tags,nata,itype, argument 41 integer nata, nat 43 character*16 tags(nata),tags_new(nat) 46 & coords(3,nata),cdist(3),cang(3) 47 integer iasym_order(nata) 59 nata_old = nata 79 do 900 i=1,nata 98 do 902 i=1,nata 117 do 904 i=1,nata 144 do 300 i=1,nata [all …]
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/symmetry/ |
H A D | sym_nwc.F | 24 subroutine sym_nwc(geom,rtdb,nata,oprint,scale,threquiv,nops) argument 77 LResult = MA_Push_Get(MT_Byte,nata*(nops+1)*16,'scratch labels', 79 LResult = MA_Push_Get(MT_Dbl,nata*(nops+1)*3,'scratch atoms', 81 Lresult = MA_Push_Get(MT_Int,nata,'distinct atoms',ldatom,idatom) 87 $ tags(1,geom),nata, 88 & itype,Byte_MB(iatags),Dbl_MB(icoord),nareal,nata*(nops+1), 141 call sym_put_in_geom(geom, nata, nareal,
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H A D | dosymops.F | 24 subroutine dosymops(symops,nops,coords,tags,nata,itype, argument 41 integer nata, nat 43 character*16 tags(nata),tags_new(nat) 46 & coords(3,nata),cdist(3),cang(3) 47 integer iasym_order(nata) 59 nata_old = nata 79 do 900 i=1,nata 98 do 902 i=1,nata 117 do 904 i=1,nata 144 do 300 i=1,nata [all …]
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/drdy/ |
H A D | nwc_s1.F | 27 Integer i, ncenter_B4_autosym, ncenter, nata local 77 nata = ncenter 78 call sym_nwc(geom,my_rtdb,nata,.false.,1.0d00,threquiv)
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H A D | nwc_s2.F | 30 Integer ncenter_B4_autosym, ncenter, nata local 93 nata = ncenter 94 call sym_nwc(geom,my_rtdb,nata,.false.,1.0d00,threquiv)
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H A D | nwc_gen.F | 31 Integer ncenter_B4_autosym, ncenter, nata local 113 nata = ncenter 114 call sym_nwc(geom,my_rtdb,nata,.false.,1.0d00,threquiv,nops,
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/drdy/ |
H A D | nwc_s1.F | 27 Integer i, ncenter_B4_autosym, ncenter, nata 77 nata = ncenter 78 call sym_nwc(geom,my_rtdb,nata,.false.,1.0d00,threquiv)
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H A D | nwc_s2.F | 30 Integer ncenter_B4_autosym, ncenter, nata 93 nata = ncenter 94 call sym_nwc(geom,my_rtdb,nata,.false.,1.0d00,threquiv)
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H A D | nwc_gen.F | 31 Integer ncenter_B4_autosym, ncenter, nata 113 nata = ncenter 114 call sym_nwc(geom,my_rtdb,nata,.false.,1.0d00,threquiv,nops,
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/geom/ |
H A D | geom_getsym.F | 28 integer nata ! num. of unique atoms 69 nata=ncenter 70 call sym_nwc(geom,rtdb,nata,oprint_sym,scale,threquiv,nops)
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/geom/ |
H A D | geom_getsym.F | 28 integer nata ! num. of unique atoms 77 nata=ncenter 78 call sym_nwc(geom,rtdb,nata,oprint_sym,scale,threquiv,nops)
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/dports/www/gitea/gitea-1.16.5/options/locale/ |
H A D | locale_cs-CZ.ini | 63 pull_requests=Požadavky na natažení 829 migrate_items_pullrequests=Požadavky na natažení 879 pulls=Požadavky na natažení 1307 pulls.new=Nový požadavek na natažení 1308 pulls.compare_changes=Nový požadavek na natažení 1316 pulls.create=Vytvořit požadavek na natažení 1329 pulls.is_closed=Požadavek na natažení byl uzavřen. 1330 pulls.has_merged=Požadavek na natažení byl sloučen. 1489 activity.title.prs_1=%d Požadavek na natažení 1490 activity.title.prs_n=%d Požadavků na natažení [all …]
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/dports/audio/festlex-czech/festival-czech-0.2.1/ |
H A D | INSTALL.cs | 34 Toto nastaven� mus� b�t provedeno je�t� p�ed nata�en�m �e�tiny popsan�m
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/dports/lang/php80/php-8.0.15/ext/standard/tests/file/ |
H A D | file_variation.phpt | 7 $data_array = array( "Garbage data", "Gar\nba\nge d\nata", "Gar\n\nbage \n\n data" );
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/dports/lang/php81/php-8.1.1/ext/standard/tests/file/ |
H A D | file_variation.phpt | 7 $data_array = array( "Garbage data", "Gar\nba\nge d\nata", "Gar\n\nbage \n\n data" );
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/dports/www/mod_php81/php-8.1.1/ext/standard/tests/file/ |
H A D | file_variation.phpt | 7 $data_array = array( "Garbage data", "Gar\nba\nge d\nata", "Gar\n\nbage \n\n data" );
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/dports/www/mod_php80/php-8.0.15/ext/standard/tests/file/ |
H A D | file_variation.phpt | 7 $data_array = array( "Garbage data", "Gar\nba\nge d\nata", "Gar\n\nbage \n\n data" );
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/dports/textproc/translate-toolkit/translate-toolkit-3.5.1/share/langmodels/ |
H A D | quechua.lm | 329 nata 42
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/dports/mail/spamassassin-devel/spamassassin-1ea352210/lm/ |
H A D | qu.lm | 329 nata 42
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/dports/lang/php73/php-7.3.33/ext/standard/tests/file/ |
H A D | file_variation.phpt | 12 $data_array = array( "Garbage data", "Gar\nba\nge d\nata", "Gar\n\nbage \n\n data" );
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/dports/lang/php74/php-7.4.27/ext/standard/tests/file/ |
H A D | file_variation.phpt | 12 $data_array = array( "Garbage data", "Gar\nba\nge d\nata", "Gar\n\nbage \n\n data" );
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/dports/textproc/libtextcat/libtextcat-2.2/langclass/LM/ |
H A D | quechua.lm | 329 nata 42
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/dports/www/mod_php73/php-7.3.33/ext/standard/tests/file/ |
H A D | file_variation.phpt | 12 $data_array = array( "Garbage data", "Gar\nba\nge d\nata", "Gar\n\nbage \n\n data" );
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/dports/www/mod_php74/php-7.4.27/ext/standard/tests/file/ |
H A D | file_variation.phpt | 12 $data_array = array( "Garbage data", "Gar\nba\nge d\nata", "Gar\n\nbage \n\n data" );
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