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/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/Parallel/
H A DParallel.F97 np_out = np_i
163 > + taskid_j*np_i
183 > + j*np_i
184 > + taskid_k*np_i*np_j)
253 np_out = np_i
350 > + taskid_j*np_i
370 > + j*np_i
390 > + taskid_j*np_i
391 > + k*np_i*np_j)
412 > + j*np_i
[all …]
H A DParallel-tcgmsg.F44 np_i = np
83 np_i = np/ncolumns
90 do i=0,np_i-1
102 do i=0,np_i-1
168 np_i = np/(ncolumns*nzones)
177 do i=0,np_i-1
183 int_mb(procNd(1) + i + j*np_i + k*np_i*np_j) = icount
191 do i=0,np_i-1
201 > + j*np_i
864 mynp = np_i
[all …]
H A DParallel-mpi.F124 np_i = np
171 np_i = np/ncolumns
177 do i=0,np_i-1
193 stupid_np_i = np_i
200 do i=0,np_i-1
237 do i=0,np_i-1
348 do i=0,np_i-1
354 int_mb(procNd(1) + i + j*np_i + k*np_i*np_j) = icount
366 stupid_np_i = np_i
374 do i=0,np_i-1
[all …]
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/Parallel/
H A DParallel-tcgmsg.F44 np_i = np
83 np_i = np/ncolumns
90 do i=0,np_i-1
102 do i=0,np_i-1
168 np_i = np/(ncolumns*nzones)
177 do i=0,np_i-1
183 int_mb(procNd(1) + i + j*np_i + k*np_i*np_j) = icount
191 do i=0,np_i-1
201 > + j*np_i
864 mynp = np_i
[all …]
H A DParallel.F97 np_out = np_i
163 > + taskid_j*np_i
183 > + j*np_i
184 > + taskid_k*np_i*np_j)
253 np_out = np_i
350 > + taskid_j*np_i
370 > + j*np_i
390 > + taskid_j*np_i
391 > + k*np_i*np_j)
412 > + j*np_i
[all …]
H A DParallel-mpi.F126 np_i = np
173 np_i = np/ncolumns
179 do i=0,np_i-1
195 stupid_np_i = np_i
202 do i=0,np_i-1
239 do i=0,np_i-1
350 do i=0,np_i-1
356 int_mb(procNd(1) + i + j*np_i + k*np_i*np_j) = icount
368 stupid_np_i = np_i
376 do i=0,np_i-1
[all …]
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/DMatrix/
H A DDMatrix-tcgmsg.F52 integer np_i,np_j
98 integer np_i,np_j
142 integer np_i,np_j
194 if (np_i.gt.1)
257 integer np_i,np_j
324 if (np_i.gt.1)
386 integer np_i,np_j
453 if (np_i.gt.1)
516 integer np_i,np_j
553 if (np_i.gt.1)
[all …]
H A DDMatrix.F28 > np_i,np_j,
32 integer np_i,np_j
33 integer block_i(0:np_i-1),block_j(0:np_j-1)
39 call icopy(np_i,0,1,block_i,1)
45 i = mod(i+1,np_i)
67 > np_i,np_j,
79 integer np_i,np_j
100 > taskid_i,taskid_j,np_i,np_j,comm_i,comm_j,
114 > np_i,np_j,
124 > np_i,np_j,
[all …]
H A DDMatrix-mpi.F52 integer np_i,np_j
80 do i=1,np_i
243 integer np_i,np_j
272 do i=1,np_i
280 if (np_i.gt.1) then
615 integer np_i,np_j
754 integer np_i,np_j
907 integer np_i,np_j
1060 integer np_i,np_j
1222 integer np_i,np_j
[all …]
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/DMatrix/
H A DDMatrix-tcgmsg.F52 integer np_i,np_j
98 integer np_i,np_j
142 integer np_i,np_j
194 if (np_i.gt.1)
257 integer np_i,np_j
324 if (np_i.gt.1)
386 integer np_i,np_j
453 if (np_i.gt.1)
516 integer np_i,np_j
553 if (np_i.gt.1)
[all …]
H A DDMatrix.F28 > np_i,np_j,
32 integer np_i,np_j
33 integer block_i(0:np_i-1),block_j(0:np_j-1)
39 call icopy(np_i,0,1,block_i,1)
45 i = mod(i+1,np_i)
67 > np_i,np_j,
79 integer np_i,np_j
100 > taskid_i,taskid_j,np_i,np_j,comm_i,comm_j,
114 > np_i,np_j,
124 > np_i,np_j,
[all …]
H A DDMatrix-mpi.F52 integer np_i,np_j
80 do i=1,np_i
243 integer np_i,np_j
272 do i=1,np_i
280 if (np_i.gt.1) then
615 integer np_i,np_j
754 integer np_i,np_j
907 integer np_i,np_j
1060 integer np_i,np_j
1222 integer np_i,np_j
[all …]
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/CMatrix/
H A DCMatrix-tcgmsg.F51 integer np_i,np_j
97 integer np_i,np_j
141 integer np_i,np_j
193 if (np_i.gt.1)
256 integer np_i,np_j
323 if (np_i.gt.1)
385 integer np_i,np_j
422 if (np_i.gt.1)
489 integer np_i,np_j
636 integer np_i,np_j
[all …]
H A DCMatrix.F28 > np_i,np_j,
32 integer np_i,np_j
33 integer block_i(0:np_i-1),block_j(0:np_j-1)
39 call icopy(np_i,0,1,block_i,1)
45 i = mod(i+1,np_i)
67 > np_i,np_j,
79 integer np_i,np_j
94 > taskid_i,taskid_j,np_i,np_j,comm_i,comm_j,
105 > np_i,np_j,
115 > np_i,np_j,
[all …]
H A DCMatrix-mpi.F52 integer np_i,np_j
80 do i=1,np_i
243 integer np_i,np_j
272 do i=1,np_i
280 if (np_i.gt.1) then
609 integer np_i,np_j
746 integer np_i,np_j
900 integer np_i,np_j
1043 integer np_i,np_j
1198 integer np_i,np_j
[all …]
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/CMatrix/
H A DCMatrix-tcgmsg.F51 integer np_i,np_j
97 integer np_i,np_j
141 integer np_i,np_j
193 if (np_i.gt.1)
256 integer np_i,np_j
323 if (np_i.gt.1)
385 integer np_i,np_j
422 if (np_i.gt.1)
489 integer np_i,np_j
636 integer np_i,np_j
[all …]
H A DCMatrix.F28 > np_i,np_j,
32 integer np_i,np_j
33 integer block_i(0:np_i-1),block_j(0:np_j-1)
39 call icopy(np_i,0,1,block_i,1)
45 i = mod(i+1,np_i)
67 > np_i,np_j,
79 integer np_i,np_j
94 > taskid_i,taskid_j,np_i,np_j,comm_i,comm_j,
105 > np_i,np_j,
115 > np_i,np_j,
[all …]
H A DCMatrix-mpi.F52 integer np_i,np_j
80 do i=1,np_i
238 integer np_i,np_j
267 do i=1,np_i
275 if (np_i.gt.1) then
595 integer np_i,np_j
729 integer np_i,np_j
880 integer np_i,np_j
1007 integer np_i,np_j
1167 integer np_i,np_j
[all …]
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/utilities/
H A Dtask_paulsmatrix.F229 integer i,j,np_i,np_j,mapping,l
246 np_i = np
251 if (abs(i-j).lt.abs(np_i-np_j)) then
252 np_i = i
260 call Parallel2d_np_i(np_i)
271 write(luout,*) "np_i = ",np_i
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/utilities/
H A Dtask_paulsmatrix.F229 integer i,j,np_i,np_j,mapping,l
246 np_i = np
251 if (abs(i-j).lt.abs(np_i-np_j)) then
252 np_i = i
260 call Parallel2d_np_i(np_i)
271 write(luout,*) "np_i = ",np_i
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/pspw/lib/psi/
H A Dpsi_dmatrix.F258 integer np_i,taskid_i,np_j local
263 call Parallel2d_np_i(np_i)
267 if (.not.BA_push_get(mt_dbl,np_i,'maxsum0',maxsum0(2),maxsum0(1)))
269 call dcopy(np_i,0.0d0,0,dbl_mb(maxsum0(1)),1)
285 call D3dB_Vector_SumAll(np_i,dbl_mb(maxsum0(1)))
288 do i = 1,np_i
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/pspw/lib/psi/
H A Dpsi_dmatrix.F258 integer np_i,taskid_i,np_j
263 call Parallel2d_np_i(np_i)
267 if (.not.BA_push_get(mt_dbl,np_i,'maxsum0',maxsum0(2),maxsum0(1)))
269 call dcopy(np_i,0.0d0,0,dbl_mb(maxsum0(1)),1)
285 call D3dB_Vector_SumAll(np_i,dbl_mb(maxsum0(1)))
288 do i = 1,np_i
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/D1dB/
H A DDne.F54 call Parallel2d_np_i(np_i)
106 i = mod(i+1,np_i)
123 do i=0,np_i-1
142 do i=0,np_i-1
165 i = mod(i+1,np_i)
959 > np_i,np_j,
1001 > np_i,np_j,
1097 > np_i,np_j,
1121 > np_i,np_j,
1221 > np_i,np_j,
[all …]
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/D1dB/
H A DDne.F54 call Parallel2d_np_i(np_i)
106 i = mod(i+1,np_i)
123 do i=0,np_i-1
142 do i=0,np_i-1
165 i = mod(i+1,np_i)
959 > np_i,np_j,
1001 > np_i,np_j,
1097 > np_i,np_j,
1121 > np_i,np_j,
1221 > np_i,np_j,
[all …]
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/Pneb/
H A DPneb.fh15 integer np_i,np_j,np_k
23 > np_i,np_j,np_k,

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