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Ni4O5Zn_12

Solved Structure

No saved CIF is available for this run. The log and PXRD CSV remain available for inspection.

Energy-R2 Fit

No Energy-R2 PNG is available for this run.

Run Summary

FormulaNi4O5Zn

Crystal Systemmonoclinic

Input SG12

Solved SGn/a

R2n/a

Chi2n/a

Rwp/Wrn/a

Statusincomplete

Valid Structures0

Candidatesn/a

Total Timen/a

Download PXRD CSV Download Log

Search Details

Phase 1 SGs21

Phase 2 Pairsn/a

Refined Structures0

Refine Failures0

Log Preview

================================================================================
Run started: 2026-05-20 01:51:12
Input: /users/qzhu8/GitHub/TEST1/PXRD-agent/GSAS_PXRD/Ni4O5Zn_12.csv
================================================================================
Per-system run log: 0518/logs/RunLog_Ni4O5Zn_12.log

Using deterministic pipeline execution.
Phase 1 — rank  1/21: spg=225 | Found 2 cell(s): vol=76.7–613.3 Å³
Phase 1 — rank  2/21: spg=216 | Found 2 cell(s): vol=76.7–613.3 Å³
Phase 1 — rank  3/21: spg=209 | Found 2 cell(s): vol=76.7–613.3 Å³
Phase 1 — rank  4/21: spg=202 | Found 2 cell(s): vol=76.7–613.3 Å³
Phase 1 — rank  5/21: spg=196 | Found 2 cell(s): vol=76.7–613.3 Å³
Phase 1 — rank  6/21: spg=230 | Found 2 cell(s): vol=216.8–1126.7 Å³
Phase 1 — rank  7/21: spg=228 | Found 1 cell(s): vol=613.3 Å³
Phase 1 — rank  8/21: spg=227 | Found 1 cell(s): vol=613.3 Å³
Phase 1 — rank  9/21: spg=226 | Found 1 cell(s): vol=613.3 Å³
Phase 1 — rank 10/21: spg=219 | Found 1 cell(s): vol=613.3 Å³
Phase 1 — rank 11/21: spg=210 | Found 1 cell(s): vol=613.3 Å³
Phase 1 — rank 12/21: spg=203 | Found 1 cell(s): vol=613.3 Å³
Phase 1 — rank 13/21: spg=229 | Found 3 cell(s): vol=216.8–1126.7 Å³
Phase 1 — rank 14/21: spg=217 | Found 3 cell(s): vol=216.8–1126.7 Å³
Phase 1 — rank 15/21: spg=214 | Found 3 cell(s): vol=216.8–1126.7 Å³
Phase 1 — rank 16/21: spg=211 | Found 3 cell(s): vol=216.8–1126.7 Å³
Phase 1 — rank 17/21: spg=206 | Found 3 cell(s): vol=216.8–1126.7 Å³
Phase 1 — rank 18/21: spg=204 | Found 3 cell(s): vol=216.8–1126.7 Å³
Phase 1 — rank 19/21: spg=199 | Found 3 cell(s): vol=216.8–1126.7 Å³
Phase 1 — rank 20/21: spg=197 | Found 3 cell(s): vol=216.8–1126.7 Å³
Phase 1 — rank 21/21: spg=220 | Found 2 cell(s): vol=216.8–1126.7 Å³
No viable (cell, SPG) pairs found; cannot proceed to structure generation.