sf_bse_tools

Scripts to assist with SF-BSE calculations

https://github.com/babarker/sf_bse_tools

Science Score: 44.0%

This score indicates how likely this project is to be science-related based on various indicators:

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CITATION.cff file
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codemeta.json file
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.zenodo.json file
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Scientific vocabulary similarity
Low similarity (1.5%) to scientific vocabulary

Last synced: 6 months ago · JSON representation ·

Repository

Scripts to assist with SF-BSE calculations

Basic Info

Host: GitHub
Owner: babarker
Language: Python
Default Branch: master
Size: 155 KB

Statistics

Stars: 0
Watchers: 1
Forks: 0
Open Issues: 0
Releases: 0

Created over 5 years ago · Last pushed 8 months ago

Metadata Files

Readme Citation

README.md

The included python scripts and test cases are used for SF-BSE applications.

Owner

Name: Bradford A Barker
Login: babarker
Kind: user
Location: Merced, CA
Company: UC Merced

Repositories: 1
Profile: https://github.com/babarker

Citation (CITATION.cff)

# This CITATION.cff file was generated with cffinit.
# Visit https://bit.ly/cffinit to generate yours today!

cff-version: 1.2.0
title: SF_BSE_tools
message: >-
  If you use this software, please cite it using the
  metadata from this file.
type: software
authors:
  - given-names: Bradford
    name-particle: Alan
    family-names: Barker
    email: bbarker6@ucmerced.edu
    affiliation: 'University of California, Merced'
    orcid: 'https://orcid.org/0000-0003-1296-3069'
  - given-names: David
    name-particle: A
    family-names: Strubbe
    email: dstrubbe@ucmerced.edu
    affiliation: 'University of California, Merced'
identifiers:
  - type: url
    value: 'https://arxiv.org/abs/2402.17719'
repository-code: 'https://github.com/babarker/SF_BSE_tools'
abstract: >-
  Python scripts to assist with the Spin-Flip Bethe-Salpeter
  Equation method of computing electronic energies and
  states for open-shell systems within Many-Body
  Perturbation Theory. For use with BerkeleyGW HDF5 format
  files, especially WFN.h5. (berkeleygw.org.)
license: MIT
version: '0.0'
date-released: '2024-04-15'

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