pyrtp

Project files/source code for the PyRTP program

https://github.com/matt-a-thompson/pyrtp

Science Score: 26.0%

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    Low similarity (4.0%) to scientific vocabulary
Last synced: 10 months ago · JSON representation

Repository

Project files/source code for the PyRTP program

Basic Info
  • Host: GitHub
  • Owner: Matt-A-Thompson
  • License: mit
  • Language: Jupyter Notebook
  • Default Branch: main
  • Size: 1.46 MB
Statistics
  • Stars: 2
  • Watchers: 2
  • Forks: 0
  • Open Issues: 3
  • Releases: 0
Created about 3 years ago · Last pushed over 2 years ago
Metadata Files
Readme License Citation

README.md

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PyRTP

Contributing authors:
Matthew Thompson - MatThompson@lincoln.ac.uk
Matt Watkins - MWatkins@lincoln.ac.uk
Warren Lynch - WLynch@lincoln.ac.uk

Date of last edit: 19/03/2024
Description: A program to perform RT-TDDFT exclusively in Python. A variety of propagators (CN, EM, ETRS, etc.) can be selected for benchmarking and testing.

System requirements: - Python >= 3.10 - Numpy >= 1.13 - npy-append-array >= 0.9.5 - Sympy >=1.7.1 - Scipy >= 0.19 - PyLibXC - Numba >= 0.51.2

Owner

  • Name: Matt Thompson
  • Login: Matt-A-Thompson
  • Kind: user
  • Location: Lincoln, UK

4th Year MPhys Physics student @ University of Lincoln, UK. Currently working on optimisation of TDDFT methods in CP2K.

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