Searched refs:offset_pe (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | xray_diffraction.F | 104 nshell_pe, offset_pe local
142 NULLIFY (offset_pe)
263 CALL reallocate(offset_pe, 0, npe - 1)
274 offset_pe(0) = 0
276 offset_pe(ipe) = offset_pe(ipe - 1) + nshell_pe(ipe - 1)
292 CALL mp_gatherv(fmax, fmax_gather, nshell_pe, offset_pe, source, group)
293 CALL mp_gatherv(fmin, fmin_gather, nshell_pe, offset_pe, source, group)
294 CALL mp_gatherv(fsum, fsum_gather, nshell_pe, offset_pe, source, group)
295 CALL mp_gatherv(f2sum, f2sum_gather, nshell_pe, offset_pe, source, group)
298 IF (ASSOCIATED(offset_pe)) THEN
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | xray_diffraction.F | 105 nshell_pe, offset_pe local
143 NULLIFY (offset_pe)
264 CALL reallocate(offset_pe, 0, npe - 1)
275 offset_pe(0) = 0
277 offset_pe(ipe) = offset_pe(ipe - 1) + nshell_pe(ipe - 1)
293 CALL mp_gatherv(fmax, fmax_gather, nshell_pe, offset_pe, source, group)
294 CALL mp_gatherv(fmin, fmin_gather, nshell_pe, offset_pe, source, group)
295 CALL mp_gatherv(fsum, fsum_gather, nshell_pe, offset_pe, source, group)
296 CALL mp_gatherv(f2sum, f2sum_gather, nshell_pe, offset_pe, source, group)
299 IF (ASSOCIATED(offset_pe)) THEN
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