lucydot effmass issues - Githubissues

lucydot / effmass

Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.

https://effmass.readthedocs.io/en/latest/

MIT License

70 stars 38 forks source link

issues

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Error while reading data from the location folder

#67 archie1511 opened 3 months ago
0
Effective masses undetectable in a command line?

#66 FPrith opened 8 months ago
1
how to efficiently select the input parameters for the targeted bands

#65 haiyuanwang2020 opened 1 year ago
2
IndexError: list index out of range with FHI-aims

#64 derLeere opened 1 year ago
2
Automatic linting

#63 lucydot opened 1 year ago
0
Improve warning messages

#62 lucydot opened 1 year ago
0
Improve label placement in output plots

#61 lucydot opened 1 year ago
0
Refactor the `extrema` module

#60 lucydot opened 1 year ago
0
Select direction

#59 lucydot closed 1 year ago
0
refactor: use `isinstance`

#58 e-kwsm closed 1 year ago
1
info file output by Octopus

#57 TS337653 closed 1 year ago
2
Add option to control figure size in plots plus fixes

#56 flokno closed 1 year ago
4
bk option in effective mass

#55 akentphonon closed 1 year ago
1
effmass

#54 isabelmoib closed 1 year ago
0
Segment selection

#53 MariaEstRo opened 2 years ago
4
Compatability with BandUP

#52 lucydot opened 2 years ago
1
Assertion Error

#51 rightsuman closed 1 year ago
3
Fix dependency name in setup.cfg

#50 musicmrman99 closed 3 years ago
0
Update installation info in docs site

#49 musicmrman99 closed 3 years ago
0
Auto versioning

#48 musicmrman99 closed 3 years ago
1
inconsistent segments

#47 ghost closed 1 year ago
3
Version number is hard-coded in welcome message

#46 ajjackson closed 3 years ago
1
Extracting effective masses just for specific directions on VB and CB in a specific range on x-axis

#45 ghost closed 1 year ago
8
Octopus DFT

#44 afatt closed 3 years ago
1
Octopus Compatibility

#43 afatt closed 3 years ago
0
Octopus DFT Compatibility

#42 afatt closed 3 years ago
0
FHI-AIMS: ValueError

#41 MariaEstRo closed 3 years ago
6
AssertionError

#40 SUN123RAY closed 1 year ago
3
Fix for output format change

#39 MatthiasGolomb closed 3 years ago
3
FHI-aims: IndexError: list index out of range

#38 ghost closed 3 years ago
10
Add vasprun parsing for split k-point paths

#37 brlec closed 3 years ago
1
Use the howfairis tool

#36 lucydot closed 1 year ago
1
Small updates to reflect a change in Aims standard output and to fix a code mistake

#35 MatthiasGolomb closed 3 years ago
1
Quantum espresso support.

#34 hongyi-zhao opened 3 years ago
5
command line interface

#33 anovitzkij closed 3 years ago
3
Cli

#32 lucydot closed 3 years ago
0
command line interface

#31 lucydot closed 3 years ago
0
Integration with ASE bandstructure object and Castep

#30 lucydot closed 3 years ago
0
Sort out dependencies

#29 lucydot closed 3 years ago
2
Update documentation

#28 lucydot opened 3 years ago
2
Effmass interface with Pymatgen

#27 lucydot opened 3 years ago
2
Publications list

#26 lucydot closed 3 years ago
1
Effmass command line interface

#25 lucydot closed 3 years ago
1
Effmass interface with ASE

#24 lucydot closed 3 years ago
2
How to select segments

#23 OldrayHex opened 3 years ago
13
partial occupancies error

#22 rightsuman closed 3 years ago
5
Added test cases for Aims

#21 MatthiasGolomb closed 3 years ago
2
Use effmass with AIMS

#20 lucydot closed 3 years ago
1
Use of effmass with quantum espresso input

#19 grayfaraday opened 4 years ago
6
Fix "3-point least-squares" typo in `print_results`

#18 kavanase closed 4 years ago
0