Issues
- 0
Fail to convert a bundle with only input files to ase object when `include_all_files=True`
#45 opened by alchem0x2A - 1
Overwriting of output files (low priority)
#43 opened by ltimmerman3 - 1
Overwriting outputs
#42 opened by ltimmerman3 - 0
Numpy Version
#41 opened by ltimmerman3 - 2
bug in interpret_kpoint_shift
#13 opened by bernstei - 4
- 5
Unexpected behavior in read()
#32 opened by ltimmerman3 - 6
- 1
Bug in specifying mesh spacing
#18 opened by ltimmerman3 - 2
- 1
Add contributor template
#21 opened by alchem0x2A - 1
Additional rules for parameters
#22 opened by alchem0x2A - 1
Incorrect dateformat parsing
#24 opened by alchem0x2A - 1
Allow customized parameter set
#23 opened by alchem0x2A - 1
python calculator doesn't support ECUT
#6 opened by bernstei - 3
non-default arguments
#5 opened by bernstei - 3
typo checking for possible mesh spacing inputs
#9 opened by bernstei - 1
makefile assumes MKL scalapack and intel MPI
#4 opened by bernstei