jli5373

I'm attempting to use casm super --duper --confignames to generate an appropriate supercell for Monte Carlo. ```casm super --duper --confignames 'SCEL2_2_1_1_0_1_1/1' 'SCEL4_4_1_1_0_1_3/4'``` returns an error of ``` -- Error: In...

casm import prepends "prim:" to "properties_origin" in import_report

2

When I do a casm import, CASM prepends "prim:" to the "properties_origin" filepath in the import_report (ie. "properties_origin" : "prim:/casmroot/path/to/properties.calc.json"). This appears to occur when the imported structures maps to...

import from 0.3 to 1.2.0 not importing properties, only structure.json

1

Trying to run 'casm import -s import_settings.json -b vasp_properties.txt' in v1.2.0 for data from v0.3 is not working. It only generates a structure.json but doesn't copy the properties.calc.json/relax.json so casm-calc...

casm import seg faults when force value is empty (in properties.calc.json)

1

In CASMv1.2.0, I'm running casm import (from properties.calc.jsons) and it seg faults when the properties.calc.json has an empty [] value for the force. I've attached the problematic properties.calc.json file in...

casm update does not default to using 'MASTER' selection. Selections for casm rm also not working as expected

1

The documentation from ```casm update -h``` indicates that casm update should default to the MASTER selection list, but unless I explicitly input `casm update -c MASTER`, it seems to attempt...

Selection for on_hull/hull distance isn't working properly

1

2 issues: 1. I ran a `casm select --set 'on_hull'` and it selected 10 configurations, of which 2 had positive hull distances. If I then run `casm select --set 'lt(hull_dist,0.001)'`...