hackingmaterials/amset
Electronic transport properties from first-principles calculations
PythonNOASSERTION
Issues
- 5
TypeError when running examples Si/GaAs.
#891 opened by sayeneBB - 1
- 2
- 5
M1 compatible?
#571 opened by janosh - 0
ValueError(f"Expected {n_expected} points but found {n_mapped}” in amset deform read module
#818 opened by antonf-ekb - 1
numpy dtype problem
#783 opened by liuzh1206 - 0
Is amset feasible for 2D materials?
#784 opened by Hemumurari - 2
Conda dependency issue
#588 opened by sinazadeh - 1
There is no available quadpy
#621 opened by carlosal1015 - 2
Atomate AMSET workflow?
#356 opened by janosh - 1
Docs Clarification on OMP_NUM_THREADS/nworkers?
#358 opened by ikirker - 1
Output data files when plotting
#282 opened by utf - 3
- 5
Question about elastic_constant.
#143 opened by plasmon1977 - 0
Dependabot couldn't authenticate with https://pypi.python.org/simple/
#221 opened by dependabot-preview - 10
Request to clarify AMSET inputs
#190 opened by rajanpir - 4
KeyError: <Spin.up: 1> when calculating SnS
#184 opened by lycheelee54 - 2
Queries with AMSET inputs...
#162 opened by rajanpir - 3
Accuracy depending on "performance settings"
#167 opened by SimonMel - 2
Error for spin-resolved HSE06 calculation with SOC
#166 opened by SimonMel - 4
Error when running Si/GaAs examples.
#138 opened by plasmon1977 - 1
Add option to choose dislocation direction
#43 opened by utf - 1
About anisotropic transport.
#140 opened by plasmon1977 - 2
TypeError when running the example
#51 opened by plasmon1977 - 0
- 0
- 0
- 1
- 0
Refactor Amset class into separate subclasses
#38 opened by utf - 1
Make Amset run from a BandStructure
#39 opened by utf - 0
core.py should not have __main__ method
#41 opened by utf - 0
Add support for SOC band structures
#46 opened by utf - 0
Command line script for running amset
#42 opened by utf - 1
email address in README
#50 opened by albalu - 1
- 0
Create documentation skeleton
#40 opened by utf