Home
last modified time | relevance | path

Searched refs:IBTP (Results 1 – 25 of 71) sorted by relevance

123

/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/lucita/
H A Ddiagonal.F74 IBTP = 2
76 NBEL = NELEC(IBTP)
78 NOCTPB = NOCTYP(IBTP)
246 IBTP = 2
248 NBEL = NELEC(IBTP)
250 NOCTPB = NOCTYP(IBTP)
382 IBTP = 2
384 NBEL = NELEC(IBTP)
386 NOCTPB = NOCTYP(IBTP)
1007 IBTP = 2
[all …]
H A Dsigma.F632 DO IBTP = 1, NOCTPB
688 DO IBTP = 1, NOCTPB
926 DO IBTP = 1, NOCTPB
1085 DO IBTP = 1, NOCTPB
1378 DO IBTP = 1, NOCTPB
3858 IBLOCK(2) = IBTP
4299 IBTP = 2
4308 NBEL = NELEC(IBTP)
4985 IBTP = 2
5000 NBEL = NELEC(IBTP)
[all …]
H A Dvecmat.F235 IBTP = 2
238 NOCTPB = NOCTYP(IBTP)
241 IOCTPB = IBSPGPFTP(IBTP)
653 IBTP = 2
656 NBEL = NELEC(IBTP)
659 NOCTPB = NOCTYP(IBTP)
662 IOCTPB = IBSPGPFTP(IBTP)
838 NIB = NSSOB(IBSM,IBTP)
940 NIB = NSSOB(IBSM,IBTP)
1084 NOCTPB = NOCTYP(IBTP)
[all …]
H A Dpar_solver.F75 IBTP = 2
78 NOCTPB = NOCTYP(IBTP)
81 IOCTPB = IBSPGPFTP(IBTP)
84 NBEL = NELEC(IBTP)
105 & WORK(KNSTSO(IBTP)),NOCTPA,NOCTPB,NSMST,LBLOCK,
132 IOCTPB = IBSPGPFTP(IBTP)
154 & WORK(KNSTSO(IBTP)),
246 IBTP = ISBLOCK(2,JSBLOCK)
250 NIB = NSSOB(IBSM,IBTP)
260 & (ICONSPB(IBTP,LLBTP).LE.MXEXC.AND.
[all …]
H A Dtransform.F503 IBTP = 2
505 NBEL = NELEC(IBTP)
529 & WORK(KNSTSO(IATP)),WORK(KNSTSO(IBTP)),
612 IBTP = IBLOCK(2,JBLOCK)
618 WRITE(lupri,*) ' IATP IBTP IASM IBSM ', IATP,IBTP,IASM,IBSM
660 CALL GETSTR_TOTSM_SPGP(2,IBTP,IBSM,NBEL,NBSTR1,IBSTR,
683 NIB = NSSOB(IBSM,IBTP)
718 IF(IRESTR.EQ.1.AND.IATP.EQ.IBTP) THEN
/dports/science/nwchem-data/nwchem-7.0.2-release/src/lucia/
H A Dgasdir2.F960 IBTP = 2
3011 IBTP = 2
3090 IBTP = 2
3289 IBTP = 2
3442 IBTP = 2
4892 MAXB0 = IMNMX(int_mb(KNSTSO(IBTP)),NSMST*NOCTYP(IBTP),2)
5916 IBTP = 2
6089 IBTP = 2
6304 IBTP = 2
8183 IBTP = 2
[all …]
H A Dluciaw.F48 IBTP = 2
51 NBEL = NELEC(IBTP)
54 NOCTPB = NOCTYP(IBTP)
57 IOCTPB = IBSPGPFTP(IBTP)
346 IBTP = 2
349 NBEL = NELEC(IBTP)
352 NOCTPB = NOCTYP(IBTP)
561 IBTP = 2
564 NBEL = NELEC(IBTP)
764 IBTP = 2
[all …]
H A Ddensi2_ab.F97 IBTP = 2
109 NOCTPB = NOCTYP(IBTP)
112 IOCTPB = IBSPGPFTP(IBTP)
115 NBEL = NELEC(IBTP)
133 MAXB0 = IMNMX(WORK(KNSTSO(IBTP)),NSMST*NOCTYP(IBTP),2)
314 & WORK(KNSTSO(IBTP)),WORK(KISTSO(IBTP)),
520 IBTP = IBLOCKL(2,IL)
556 IBTP = IBLOCKL(2,IL)
610 IBTP = IBLOCKL(2,IL)
616 NIB = NSSOB(IBSM,IBTP)
[all …]
H A Dtestcase-O3.output1136 ZTEST: IATP, IBTP = 1 2
1148 ZTEST: IATP, IBTP = 1 2
1190 ZTEST: IATP, IBTP = 1 2
1204 ZTEST: IATP, IBTP = 1 2
1351 ZTEST: IATP, IBTP = 1 2
1365 ZTEST: IATP, IBTP = 1 2
1512 ZTEST: IATP, IBTP = 1 2
1526 ZTEST: IATP, IBTP = 1 2
1673 ZTEST: IATP, IBTP = 1 2
1687 ZTEST: IATP, IBTP = 1 2
[all …]
H A Dgasdir2.F_vog051496 C & (IBTP.EQ.18.AND.JBTP.EQ.4.OR.IBTP.EQ.4.AND.JBTP.EQ.18)) THEN
105 WRITE(6,*) ' IATP IBTP JATP JBTP ',IATP,IBTP,JATP,JBTP
943 IBTP = 2
1288 C? WRITE(6,*) ' ISPC IATP IBTP ', ISPC,IATP,IBTP
2994 IBTP = 2
3073 IBTP = 2
3272 IBTP = 2
3425 IBTP = 2
4688 C? & ' RFTTS : IATP IBTP IASM IBSM ',IATP,IBTP,IASM,IBSM
6064 IBTP = 2
[all …]
H A Dlucia1.F1576 IBTP = IBSTFI(INTSPC)
1585 NOCTPB = NOCTYP(IBTP)
1590 & WORK(KEL3(IATP)),WORK(KEL1(IBTP)),WORK(KEL3(IBTP)),
2522 KBTP = IBTP
2533 KBTP = IBTP
2547 KATP = IBTP
2562 KATP = IBTP
2610 & IASM,IBSM,IATP,IBTP
2955 IBTP = IBSTFI(INTSPC)
2957 NOCTPB = NOCTYP(IBTP)
[all …]
H A Dlucia_gencc2.F92 IBTP = 2
95 NBEL = NELEC(IBTP)
206 IBTP = 2
207 IOCTPB = IBSPGPFTP(IBTP)
208 NOCTPB = NSPGPFTP(IBTP)
412 IBTP = 2
415 NBEL = NELEC(IBTP)
535 NOCTPB = NOCTYP(IBTP)
561 & WORK(KNSTSO(IBTP)),
1405 SUBROUTINE CIBLOCKS_FOR_TT(ICIBLK,NCIBLK,IATP,IBTP,IFORM,ITTBLK) argument
[all …]
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/lucia/
H A Dgasdir2.F960 IBTP = 2
3011 IBTP = 2
3090 IBTP = 2
3289 IBTP = 2
3442 IBTP = 2
4892 MAXB0 = IMNMX(int_mb(KNSTSO(IBTP)),NSMST*NOCTYP(IBTP),2)
5916 IBTP = 2
6089 IBTP = 2
6304 IBTP = 2
8183 IBTP = 2
[all …]
H A Dluciaw.F48 IBTP = 2
51 NBEL = NELEC(IBTP)
54 NOCTPB = NOCTYP(IBTP)
57 IOCTPB = IBSPGPFTP(IBTP)
346 IBTP = 2
349 NBEL = NELEC(IBTP)
352 NOCTPB = NOCTYP(IBTP)
561 IBTP = 2
564 NBEL = NELEC(IBTP)
764 IBTP = 2
[all …]
H A Ddensi2_ab.F97 IBTP = 2
109 NOCTPB = NOCTYP(IBTP)
112 IOCTPB = IBSPGPFTP(IBTP)
115 NBEL = NELEC(IBTP)
133 MAXB0 = IMNMX(WORK(KNSTSO(IBTP)),NSMST*NOCTYP(IBTP),2)
314 & WORK(KNSTSO(IBTP)),WORK(KISTSO(IBTP)),
520 IBTP = IBLOCKL(2,IL)
556 IBTP = IBLOCKL(2,IL)
610 IBTP = IBLOCKL(2,IL)
616 NIB = NSSOB(IBSM,IBTP)
[all …]
H A Dtestcase-O3.output1136 ZTEST: IATP, IBTP = 1 2
1148 ZTEST: IATP, IBTP = 1 2
1190 ZTEST: IATP, IBTP = 1 2
1204 ZTEST: IATP, IBTP = 1 2
1351 ZTEST: IATP, IBTP = 1 2
1365 ZTEST: IATP, IBTP = 1 2
1512 ZTEST: IATP, IBTP = 1 2
1526 ZTEST: IATP, IBTP = 1 2
1673 ZTEST: IATP, IBTP = 1 2
1687 ZTEST: IATP, IBTP = 1 2
[all …]
H A Dgasdir2.F_vog051496 C & (IBTP.EQ.18.AND.JBTP.EQ.4.OR.IBTP.EQ.4.AND.JBTP.EQ.18)) THEN
105 WRITE(6,*) ' IATP IBTP JATP JBTP ',IATP,IBTP,JATP,JBTP
943 IBTP = 2
1288 C? WRITE(6,*) ' ISPC IATP IBTP ', ISPC,IATP,IBTP
2994 IBTP = 2
3073 IBTP = 2
3272 IBTP = 2
3425 IBTP = 2
4688 C? & ' RFTTS : IATP IBTP IASM IBSM ',IATP,IBTP,IASM,IBSM
6064 IBTP = 2
[all …]
H A Dlucia1.F1576 IBTP = IBSTFI(INTSPC)
1585 NOCTPB = NOCTYP(IBTP)
1590 & WORK(KEL3(IATP)),WORK(KEL1(IBTP)),WORK(KEL3(IBTP)),
2522 KBTP = IBTP
2533 KBTP = IBTP
2547 KATP = IBTP
2562 KATP = IBTP
2610 & IASM,IBSM,IATP,IBTP
2955 IBTP = IBSTFI(INTSPC)
2957 NOCTPB = NOCTYP(IBTP)
[all …]
H A Dlucia_gencc2.F92 IBTP = 2
95 NBEL = NELEC(IBTP)
206 IBTP = 2
207 IOCTPB = IBSPGPFTP(IBTP)
208 NOCTPB = NSPGPFTP(IBTP)
412 IBTP = 2
415 NBEL = NELEC(IBTP)
535 NOCTPB = NOCTYP(IBTP)
561 & WORK(KNSTSO(IBTP)),
1405 SUBROUTINE CIBLOCKS_FOR_TT(ICIBLK,NCIBLK,IATP,IBTP,IFORM,ITTBLK) argument
[all …]
/dports/misc/libemos/libemos-4.5.9-Source/bufrdc_wmo/
H A Dbugetbm.F142 IBTP=NBITP (I-1)
144 IBTP=IBTP+NWTDW(I-1)
145 IF(IBTP.GE.NBPW) THEN
146 IW=IBTP/NBPW
147 IBTP=IBTP-IW*NBPW
150 CALL BUNPCK(NBPW,KBUFF,IDWINC,IWRD,IBTP,6,KERR)
H A Dbuuatb.F243 IBTP=IBITP
251 IBTP=IBTP+NWTDW(I-1)
252 IF(IBTP.GE.NBPW) THEN
253 IW=IBTP/NBPW
254 IBTP=IBTP-IW*NBPW
258 CALL BUNPCK(NBPW,KBUFF,IDWINC,IWRD,IBTP,6,KERR)
H A Dbusrp.F290 IBTP=IBITP
298 IBTP=IBTP+NWTDW(I-1)
299 IF(IBTP.GE.NBPW) THEN
300 IW=IBTP/NBPW
301 IBTP=IBTP-IW*NBPW
305 CALL BUNPCK(NBPW,KBUFF,IDWINC,IWRD,IBTP,6,KERR)
/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/sirius/
H A Ddets1.F127 DO 900 IBTP = 1,NOCTPB
128 IF(IOCOC(IATP,IBTP) .NE. 1 ) GOTO 900
129 IBSTRT = ISSOB(IBTP,IBSM)
130 IBSTOP = IBSTRT + NSSOB(IBTP,IBSM)-1
184 DO 1900 IBTP = 1, NOCTPB
185 IF( IOCOC(IATP,IBTP) .NE. 1 ) GOTO 1900
186 NB = NSSOB(IBTP,IBSM)
188 IOFF1 = ICOOS(IBTP,IATP,IASM)
189 IOFF2 = ICOOS(IATP,IBTP,IBSM)
190 IF(IATP .EQ. IBTP ) THEN
H A Dcsfstuff.F786 IBTP = ITPFSB(IBNUM)
3433 DO 1801 IBTP = 1, NOCTPB
3440 MNIATP = IBTP
3635 DO 4700 IBTP = 1, IATP
3698 DO 7645 IBTP = 1,IBTPMX
3836 IATPMN = IBTP
3839 IATPMN = IBTP
4017 DO 6700 IBTP = 1, IATP
5451 DO 100 IBTP = 1, NOCTPB
5455 NDTPBL(IATP,IBTP) = NSOA(IATP)*NSOB(IBTP)
[all …]
/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/gp/
H A Dgplucia.F1821 IF(IATP.GT.IBTP) THEN
1876 IF(IBTP.GT.IATP) THEN
3102 IB = IBTP
3118 IBTP = IB
3315 KBTP = IBTP
3326 KBTP = IBTP
3340 KATP = IBTP
3355 KATP = IBTP
3403 & IASM,IBSM,IATP,IBTP
3551 NIB = NSBSO(IBSM,IBTP)
[all …]

123