Comments (2)
Dear @sjjamsa , as you may notice, all original authors of BandUP have limited time to maintain the code. We try our best, but we welcome contributions from the community.
If you have experience with that, please make a pull request, and we will further upload it to pupi, and your name will be acknowledged.
Also, there is a purely pythonic implementation banduppy, but it is a different code not using routines of the original bandUP, so functionalities may differ.
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Hi!
Thank you for your response. A colleague asked for help in installing bandup onto our cluster. He never followed up on the topic, so this issue has been dormant on my side as well.
I'll add a link to the python version to the near-forgotten ticket on our cluster.
I think I'll close this ticket here as well.
Cheerio!
- Simppa -
from bandup.
Related Issues (20)
- error in running bandup example2 HOT 1
- error in when running bandup in example2 step 4 HOT 2
- Postprocessing issue in BandUP V2.9.0 HOT 1
- orbital projection HOT 3
- Error while generating the supercell k-path HOT 3
- Compilation failure due to missing file (spglib) HOT 5
- Error when compiling (./build) HOT 3
- Error while compiling spglib-1.5.2 HOT 1
- UnicodeDecodeError while generating SC k-path HOT 2
- Bandup plot HOT 1
- Carrier effective mass calculation HOT 1
- what version of quantum espresso is compatible with bandup? HOT 3
- Error while executing the ./build command
- Error while executing the ./build command HOT 1
- Not understanding the colour mapped Electronic bands structure
- not work with Quantum Espresso 6.5 or beyond
- Problem facing with './build' HOT 1
- Installation problem on Mac M2
- vmax and ticks HOT 2
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