Pinned Repositories
Molecule-Shifter-Stretcher
Shifting structures vertically and stretching molecules proportionately.
Deleting-atoms
maise
MAISE Module for Ab Initio Structure Evolution (MAISE)
texstudio
TeXstudio is a fully featured LaTeX editor. Our goal is to make writing LaTeX documents as easy and comfortable as possible.
Trajectory-Analysis
These codes are being used to analyze the AIMD/CMD trajectories stored in the .xyz format.
Form-ML_ABN-File
Hashan-Peiris.github.io
My Site
JAX-ReaxFF
JAX-ReaxFF: A Gradient Based Framework for Extremely Fast Optimization of Reactive Force Fields
APS-GDS-March-2024-Data-Science-Tutorial
Hashan-Peiris's Repositories
Hashan-Peiris/Hashan-Peiris.github.io
My Site
Hashan-Peiris/Form-ML_ABN-File
Hashan-Peiris/Trajectory-Analysis
These codes are being used to analyze the AIMD/CMD trajectories stored in the .xyz format.
Hashan-Peiris/APS-GDS-March-2024-Data-Science-Tutorial
Hashan-Peiris/ML_FF_VASP
Hashan-Peiris/galore
Gaussian and Lorentzian smearing of simulated spectra
Hashan-Peiris/WhatATheme
A customizable Jekyll Portfolio theme which supports blogging.
Hashan-Peiris/jekyll-uno-timeline
A Jekyll Theme, based on the Uno-Theme with some adjustments.
Hashan-Peiris/Deleting-atoms
Hashan-Peiris/Automatic-Job-Submitter
Hashan-Peiris/Molecule-Shifter-Stretcher
Shifting structures vertically and stretching molecules proportionately.
Hashan-Peiris/JAX-ReaxFF
JAX-ReaxFF: A Gradient Based Framework for Extremely Fast Optimization of Reactive Force Fields
Hashan-Peiris/sod
Site-Occupation Disorder
Hashan-Peiris/chargemol
2017-09-26 Linux source.
Hashan-Peiris/maise
MAISE Module for Ab Initio Structure Evolution (MAISE)