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Corrections to Wyckoff coded strings (thanks to Will Lenthe)
Docker Image CI Ubuntu #34: Commit 2c071d6 pushed by marcdegraef
September 13, 2024 18:02 1h 16m 26s develop
September 13, 2024 18:02 1h 16m 26s
various updates and bug fixes
Docker Image CI Ubuntu #33: Commit 34c0770 pushed by marcdegraef
August 13, 2024 17:01 1h 15m 21s develop
August 13, 2024 17:01 1h 15m 21s
correction of dataset names for TKD pattner center fitting
Docker Image CI Ubuntu #32: Commit 61752f7 pushed by marcdegraef
July 19, 2024 12:54 1h 15m 31s develop
July 19, 2024 12:54 1h 15m 31s