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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/mp2_grad/
H A Dmp2_make_dip_mom.F24 double precision ndip(3)
91 if (.not. geom_nuc_dipole(geom,ndip))
97 write(6,2) 'X', ndip(1), scfx+ndip(1),mp2x+scfx+ndip(1)
98 write(6,2) 'Y', ndip(2), scfy+ndip(2),mp2y+scfy+ndip(2)
99 write(6,2) 'Z', ndip(3), scfz+ndip(3),mp2z+scfz+ndip(3)
112 ndip(1) = mp2x+scfx+ndip(1)
113 ndip(2) = mp2y+scfy+ndip(2)
114 ndip(3) = mp2z+scfz+ndip(3)
116 if (.not. rtdb_put(rtdb,'mp2:dipole',mt_dbl,3,ndip))
119 call ecce_print1('total dipole', mt_dbl, ndip, 3)
/dports/science/nwchem-data/nwchem-7.0.2-release/src/mp2_grad/
H A Dmp2_make_dip_mom.F24 double precision ndip(3)
91 if (.not. geom_nuc_dipole(geom,ndip))
97 write(6,2) 'X', ndip(1), scfx+ndip(1),mp2x+scfx+ndip(1)
98 write(6,2) 'Y', ndip(2), scfy+ndip(2),mp2y+scfy+ndip(2)
99 write(6,2) 'Z', ndip(3), scfz+ndip(3),mp2z+scfz+ndip(3)
112 ndip(1) = mp2x+scfx+ndip(1)
113 ndip(2) = mp2y+scfy+ndip(2)
114 ndip(3) = mp2z+scfz+ndip(3)
116 if (.not. rtdb_put(rtdb,'mp2:dipole',mt_dbl,3,ndip))
119 call ecce_print1('total dipole', mt_dbl, ndip, 3)
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwdft/rt_tddft/init/
H A Drt_tddft_init_geoms.F73 double precision ndip(3)
155 if (.not. geom_nuc_dipole (geom_tmp, ndip))
248 params%geom(ig)%ndip%x = ndip(1)
249 params%geom(ig)%ndip%y = ndip(2)
250 params%geom(ig)%ndip%z = ndip(3)
304 $ params%geom(ig)%ndip%x,
305 $ params%geom(ig)%ndip%y,
306 $ params%geom(ig)%ndip%z
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwdft/rt_tddft/init/
H A Drt_tddft_init_geoms.F73 double precision ndip(3)
155 if (.not. geom_nuc_dipole (geom_tmp, ndip))
248 params%geom(ig)%ndip%x = ndip(1)
249 params%geom(ig)%ndip%y = ndip(2)
250 params%geom(ig)%ndip%z = ndip(3)
304 $ params%geom(ig)%ndip%x,
305 $ params%geom(ig)%ndip%y,
306 $ params%geom(ig)%ndip%z
/dports/multimedia/v4l_compat/linux-5.13-rc2/fs/gfs2/
H A Dinode.c1406 error = gfs2_qa_get(ndip); in gfs2_rename()
1410 if (odip != ndip) { in gfs2_rename()
1427 if (odip != ndip) { in gfs2_rename()
1517 if (odip != ndip) { in gfs2_rename()
1591 gfs2_inplace_release(ndip); in gfs2_rename()
1594 gfs2_quota_unlock(ndip); in gfs2_rename()
1609 gfs2_qa_put(ndip); in gfs2_rename()
1645 if (odip != ndip) { in gfs2_exchange()
1668 if (odip != ndip) { in gfs2_exchange()
1734 if (odip != ndip) { in gfs2_exchange()
[all …]
/dports/multimedia/libv4l/linux-5.13-rc2/fs/gfs2/
H A Dinode.c1406 error = gfs2_qa_get(ndip); in gfs2_rename()
1410 if (odip != ndip) { in gfs2_rename()
1427 if (odip != ndip) { in gfs2_rename()
1517 if (odip != ndip) { in gfs2_rename()
1591 gfs2_inplace_release(ndip); in gfs2_rename()
1594 gfs2_quota_unlock(ndip); in gfs2_rename()
1609 gfs2_qa_put(ndip); in gfs2_rename()
1645 if (odip != ndip) { in gfs2_exchange()
1668 if (odip != ndip) { in gfs2_exchange()
1734 if (odip != ndip) { in gfs2_exchange()
[all …]
/dports/multimedia/v4l-utils/linux-5.13-rc2/fs/gfs2/
H A Dinode.c1406 error = gfs2_qa_get(ndip); in gfs2_rename()
1410 if (odip != ndip) { in gfs2_rename()
1427 if (odip != ndip) { in gfs2_rename()
1517 if (odip != ndip) { in gfs2_rename()
1591 gfs2_inplace_release(ndip); in gfs2_rename()
1594 gfs2_quota_unlock(ndip); in gfs2_rename()
1609 gfs2_qa_put(ndip); in gfs2_rename()
1645 if (odip != ndip) { in gfs2_exchange()
1668 if (odip != ndip) { in gfs2_exchange()
1734 if (odip != ndip) { in gfs2_exchange()
[all …]
/dports/www/chromium-legacy/chromium-88.0.4324.182/native_client/src/trusted/desc/
H A Dnacl_desc_quota_test.c216 struct NaClDescIoDesc *ndip = NULL; in main() local
274 if (NULL == (ndip = NaClDescIoDescOpen(file_path, in main()
306 (struct NaClDesc *) ndip, in main()
321 ndip = NULL; /* object_under_test has ownership */ in main()
356 NaClDescSafeUnref((struct NaClDesc *) ndip); in main()
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwdft/rt_tddft/rtutils/
H A Drt_tddft_calc.F175 dipmom%x = params%geom(ig)%ndip%x - dipmom%x
184 dipmom%y = params%geom(ig)%ndip%y - dipmom%y
193 dipmom%z = params%geom(ig)%ndip%z - dipmom%z
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwdft/rt_tddft/rtutils/
H A Drt_tddft_calc.F175 dipmom%x = params%geom(ig)%ndip%x - dipmom%x
184 dipmom%y = params%geom(ig)%ndip%y - dipmom%y
193 dipmom%z = params%geom(ig)%ndip%z - dipmom%z
/dports/science/nwchem-data/nwchem-7.0.2-release/src/argos/
H A Dargos_wtrest.F48 write(lfn,1014) nfdip,ndip,rdip
H A Dargos_rdrest.F59 read(lfn,1014) nfdip,ndip,rdip
H A Dargos.fh150 + ngrww,ngrsw,ngrss,ndip,numhis,numdis,lnghis,lngdis,nfacfa,
182 + ngrww,ngrsw,ngrss,ndip,numhis,numdis,lnghis,lngdis,nfacfa,
H A Dargos_rdinp.F233 ndip=0
956 ndip=0
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/argos/
H A Dargos_wtrest.F48 write(lfn,1014) nfdip,ndip,rdip
H A Dargos_rdrest.F59 read(lfn,1014) nfdip,ndip,rdip
H A Dargos.fh150 + ngrww,ngrsw,ngrss,ndip,numhis,numdis,lnghis,lngdis,nfacfa,
182 + ngrww,ngrsw,ngrss,ndip,numhis,numdis,lnghis,lngdis,nfacfa,
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/vscf/
H A Dvscf.F1991 SUBROUTINE VSCF_RDDIAG(RQ,DQ,diagV,DMX,DMY,DMZ,NM,N,ndip,
2007 if (ndip.eq.1) then
2041 if (ndip.eq.1) then
2055 SUBROUTINE RDCOUP(coupV,NM,N,NSTART,dm2x,dm2y,dm2z,lcoup,ndip)
2070 if (ndip.eq.1) then
2111 if (ndip.eq.1) then
2584 & dm1z,dm2x,dm2y,dm2z,coupv,tripv,ndip)
2655 CALL VSCF_RDDIAG(rq,dq,diagv,dm1x,dm1y,dm1z,nnm,ngrid,ndip,
2660 CALL RDCOUP(coupv,nnm,ngrid,nstart,dm2x,dm2y,dm2z,lcoup,ndip)
/dports/science/nwchem-data/nwchem-7.0.2-release/src/vscf/
H A Dvscf.F1991 SUBROUTINE VSCF_RDDIAG(RQ,DQ,diagV,DMX,DMY,DMZ,NM,N,ndip,
2007 if (ndip.eq.1) then
2041 if (ndip.eq.1) then
2055 SUBROUTINE RDCOUP(coupV,NM,N,NSTART,dm2x,dm2y,dm2z,lcoup,ndip)
2070 if (ndip.eq.1) then
2111 if (ndip.eq.1) then
2584 & dm1z,dm2x,dm2y,dm2z,coupv,tripv,ndip)
2655 CALL VSCF_RDDIAG(rq,dq,diagv,dm1x,dm1y,dm1z,nnm,ngrid,ndip,
2660 CALL RDCOUP(coupv,nnm,ngrid,nstart,dm2x,dm2y,dm2z,lcoup,ndip)
/dports/science/nwchem-data/nwchem-7.0.2-release/src/hessian/analytic/
H A Dhess_cphf.F24 integer nbf2, ndns, ndip
354 ndip = 3
356 $ ocphfprint, nocc, nvirt, ndens, ndip, nbf)
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/hessian/analytic/
H A Dhess_cphf.F24 integer nbf2, ndns, ndip
354 ndip = 3
356 $ ocphfprint, nocc, nvirt, ndens, ndip, nbf)
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwmd/
H A Dmd_common.fh138 + ngrww,ngrsw,ngrss,ndip,numhis,numdis,lnghis,lngdis,nfacfa,
170 + ngrww,ngrsw,ngrss,ndip,numhis,numdis,lnghis,lngdis,nfacfa,
H A Dmd_start.F560 ndip=0
1304 ndip=0
1706 read(lfn,1014) nfdip,ndip,rdip
1770 write(lfn,1014) nfdip,ndip,rdip
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwmd/
H A Dmd_common.fh138 + ngrww,ngrsw,ngrss,ndip,numhis,numdis,lnghis,lngdis,nfacfa,
170 + ngrww,ngrsw,ngrss,ndip,numhis,numdis,lnghis,lngdis,nfacfa,
H A Dmd_start.F560 ndip=0
1304 ndip=0
1709 read(lfn,1014) nfdip,ndip,rdip
1773 write(lfn,1014) nfdip,ndip,rdip

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