Ticket #4677 (closed: fixed)

Opened 9 years ago

Last modified 5 years ago

Add PointGroups to IndexingUtils.cpp

Reported by: Vickie Lynch Owned by: Vickie Lynch
Priority: major Milestone: Release 2.1
Component: Mantid Keywords:
Cc: Blocked By:
Blocking: Tester: Janik Zikovsky

Description

SortHKL needs to know which hkl are symmetrically equivalent. This has been done in CrystalPlan/model/crystals.py.

Change History

comment:1 Changed 9 years ago by Vickie Lynch

  • Status changed from new to accepted

comment:2 Changed 9 years ago by Vickie Lynch

Refs #4677 use PointGroups in SortHKL

Changeset: 5c693cbc8c8c740d20c79e39d266318f8cc90bcd

comment:3 Changed 9 years ago by Vickie Lynch

Refs #4677 sort by banks first; no statistics of one row

Changeset: 5f3603d33e1ff24306089cae2534523b89dc58a1

comment:4 Changed 9 years ago by Vickie Lynch

Refs #4677 sort by point groups

Changeset: 580c6c244db742534aa3507dfe10f13a98f2f084

comment:5 Changed 9 years ago by Vickie Lynch

Refs #4677 Sort by point groups(same as last 3 commits to iteration33)

Changeset: 90ff44ccb32c60555dd5c59ae78f48f3bca891c8

comment:6 Changed 9 years ago by Vickie Lynch

Refs #4677 Sort by point groups(same as last 3 commits to iteration33)

Changeset: 90ff44ccb32c60555dd5c59ae78f48f3bca891c8

comment:7 Changed 9 years ago by Vickie Lynch

Refs #4677 output all peaks

Changeset: 6bcfb9bbca874e56b974325af3afd0fc3e0757c9

comment:8 Changed 9 years ago by Vickie Lynch

  • Status changed from accepted to verify
  • Resolution set to fixed

Test with SortHKL after LoadHKL or LoadIsawPeaks

comment:9 Changed 8 years ago by Janik Zikovsky

  • Status changed from verify to verifying
  • Tester set to Janik Zikovsky

comment:10 Changed 8 years ago by Janik Zikovsky

Refs #4677: unit test for PointGroup and -31m fix

Changeset: 0b2b605b3bc5b1d097b3b658a4ccb3aa6791fe89

comment:11 Changed 8 years ago by Janik Zikovsky

  • Status changed from verifying to closed

Added unit test to confirm functionality.

comment:12 Changed 8 years ago by Janik Zikovsky

Refs #4677: fix bad include

Changeset: 211415f3f316bc88d9db5d1f710aa519c65deff8

comment:13 Changed 8 years ago by Janik Zikovsky

Refs #4677: unit test for PointGroup and -31m fix

Changeset: 66c3b3c4131285d88a6a4b1d87a1513af2103fa5

comment:14 Changed 8 years ago by Janik Zikovsky

Refs #4677: fix bad include

Changeset: 8a67ed0bc64cc951ec4cbf5051a6829ece540099

comment:15 Changed 8 years ago by Janik Zikovsky

Refs #4677: unit test for PointGroup and -31m fix

Changeset: 66c3b3c4131285d88a6a4b1d87a1513af2103fa5

comment:16 Changed 8 years ago by Janik Zikovsky

Refs #4677: fix bad include

Changeset: 8a67ed0bc64cc951ec4cbf5051a6829ece540099

comment:17 Changed 5 years ago by Stuart Campbell

This ticket has been transferred to github issue 5524

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