From 2755f5a9d063588960e9565c9efc30c170a86bc1 Mon Sep 17 00:00:00 2001 From: rees-c Date: Tue, 25 Nov 2025 15:48:11 -0600 Subject: [PATCH] bug fix layer group 52, Wyckoff 4c --- pyxtal/database/layer.csv | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/pyxtal/database/layer.csv b/pyxtal/database/layer.csv index fcddca52..249ff919 100644 --- a/pyxtal/database/layer.csv +++ b/pyxtal/database/layer.csv @@ -51,7 +51,7 @@ 49,"[['x,y,z','-x,-y,z','-y,x,z','y,-x,z'],['0,1/2,z','1/2,0,z'],['1/2,1/2,z'],['0,0,z']]" 50,"[['x,y,z','-x,-y,z','y,-x,-z','-y,x,-z'],['0,1/2,z','1/2,0,-z'],['1/2,1/2,z','1/2,1/2,-z'],['0,0,z','0,0,-z'],['1/2,1/2,0'],['0,0,0']]" 51,"[['x,y,z','-x,-y,z','-y,x,z','y,-x,z','-x,-y,-z','x,y,-z','y,-x,-z','-y,x,-z'],['x,y,0','-x,-y,0','-y,x,0','y,-x,0'],['0,1/2,z','1/2,0,z','0,1/2,-z','1/2,0,-z'],['1/2,1/2,z','1/2,1/2,-z'],['0,0,z','0,0,-z'],['0,1/2,0','1/2,0,0'],['1/2,1/2,0'],['0,0,0']]" -52,"[['x,y,z','-x+1/2,-y+1/2,z','-y+1/2,x,z','y,-x+1/2,z','-x,-y,-z','x+1/2,y+1/2,-z','y+1/2,-x,-z','-y,x+1/2,-z'],['1/4,3/4,z','3/4,1/4,z','3/4,1/4,-z','1/4,3/4,-z'],['0,0,0','1/2,1/2,0','1/2,0,0','0,0,0'],['1/4,1/4,z','3/4,3/4,-z'],['1/4,3/4,0','3/4,1/4,0']]" +52,"[['x,y,z','-x+1/2,-y+1/2,z','-y+1/2,x,z','y,-x+1/2,z','-x,-y,-z','x+1/2,y+1/2,-z','y+1/2,-x,-z','-y,x+1/2,-z'],['1/4,3/4,z','3/4,1/4,z','3/4,1/4,-z','1/4,3/4,-z'],['0,0,0','1/2,1/2,0','1/2,0,0','0,1/2,0'],['1/4,1/4,z','3/4,3/4,-z'],['1/4,3/4,0','3/4,1/4,0']]" 53,"[['x,y,z','-x,-y,z','-y,x,z','y,-x,z','-x,y,-z','x,-y,-z','y,x,-z','-y,-x,-z'],['x,1/2,0','-x,1/2,0','1/2,x,0','1/2,-x,0'],['x,0,0','-x,0,0','0,x,0','0,-x,0'],['x,x,0','-x,-x,0','-x,x,0','x,-x,0'],['0,1/2,z','1/2,0,z','0,1/2,-z','1/2,0,-z'],['1/2,1/2,z','1/2,1/2,-z'],['0,0,z','0,0,-z'],['1/2,0,0','0,1/2,0'],['1/2,1/2,0'],['0,0,0']]" 54,"[['x,y,z','-x,-y,z','-y,x,z','y,-x,z','-x+1/2,y+1/2,-z','x+1/2,-y+1/2,-z','y+1/2,x+1/2,-z','-y+1/2,-x+1/2,-z'],['x,x+1/2,0','-x,-x+1/2,0','-x+1/2,x,0','x+1/2,-x,0'],['0,1/2,z','1/2,0,z','1/2,0,-z','0,1/2,-z'],['0,0,z','1/2,1/2,-z'],['0,1/2,0','1/2,0,0']]" 55,"[['x,y,z','-x,-y,z','-y,x,z','y,-x,z','x,-y,z','-x,y,z','-y,-x,z','y,x,z'],['x,1/2,z','-x,1/2,z','1/2,x,z','1/2,-x,z'],['x,0,z','-x,0,z','0,x,z','0,-x,z'],['x,x,z','-x,-x,z','-x,x,z','x,-x,z'],['1/2,0,z','0,1/2,z'],['1/2,1/2,z'],['0,0,z']]"