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Fix syntax in default values involving lists and matrices #1

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Fix syntax in default values involving lists and matrices #1

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19 changes: 11 additions & 8 deletions cif_ms.dic
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Original file line number Diff line number Diff line change
Expand Up @@ -3343,7 +3343,7 @@ save_atom_site_displace_special_func.sawtooth_axyz
_type.container Matrix
_type.dimension '[3]'
_type.contents Real
_enumeration.default [0.0,0.0,0.0]
_enumeration.default [0.0 0.0 0.0]
_units.code none
_method.purpose Evaluation
_method.expression
Expand Down Expand Up @@ -3594,7 +3594,7 @@ save_atom_site_displace_special_func.zigzag_axyz
_type.container Matrix
_type.dimension '[3]'
_type.contents Real
_enumeration.default [0.0,0.0,0.0]
_enumeration.default [0.0 0.0 0.0]
_units.code none

save_
Expand Down Expand Up @@ -7248,7 +7248,7 @@ save_atom_site_rot_special_func.sawtooth_axyz
_type.container Matrix
_type.dimension '[3]'
_type.contents Real
_enumeration.default [0.0,0.0,0.0]
_enumeration.default [0.0 0.0 0.0]
_units.code degrees
_method.purpose Evaluation
_method.expression
Expand Down Expand Up @@ -7493,7 +7493,7 @@ save_atom_site_rot_special_func.zigzag_axyz
_type.container Matrix
_type.dimension '[3]'
_type.contents Real
_enumeration.default [0.0,0.0,0.0]
_enumeration.default [0.0 0.0 0.0]
_units.code degrees

save_
Expand Down Expand Up @@ -9069,8 +9069,9 @@ save_atom_sites_axes.matrix
_type.dimension '[3,3]'
_type.contents Real
_enumeration.default [
[1.0,0.0,0.0] , [0.0,1.0,0.0] ,
[0.0,0.0,1.0]
[1.0 0.0 0.0]
[0.0 1.0 0.0]
[0.0 0.0 1.0]
]

save_
Expand Down Expand Up @@ -9825,7 +9826,9 @@ save_cell.commen_supercell_matrix
_type.dimension '[3,3]'
_type.contents Integer
_enumeration.default [
[1,0,0] , [0,1,0] , [0,0,1]
[1 0 0]
[0 1 0]
[0 0 1]
]
_description_example.case
;
Expand All @@ -9840,7 +9843,7 @@ save_cell.commen_supercell_matrix
_cell_wave_vector.z
1 0.250000 0.000000 -0.250000

_cell.commen_supercell_matrix [[1,0,-3],[0,1,0],[1,0,1]]
_cell.commen_supercell_matrix [[1 0 -3] [0 1 0] [1 0 1]]

# - - - - data truncated for brevity - - - -

Expand Down