Hashan Peiris (Hashan-Peiris)

Hashan-Peiris

Geek Repo

Company:Binghamton University

Location:New York, USA

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Hashan Peiris's repositories

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JAX-ReaxFF

JAX-ReaxFF: A Gradient Based Framework for Extremely Fast Optimization of Reactive Force Fields

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Molecule-Shifter-Stretcher

Shifting structures vertically and stretching molecules proportionately.

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Trajectory-Analysis

These codes are being used to analyze the AIMD/CMD trajectories stored in the .xyz format.

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maise

MAISE Module for Ab Initio Structure Evolution (MAISE)

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chargemol

2017-09-26 Linux source.

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galore

Gaussian and Lorentzian smearing of simulated spectra

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jekyll-uno-timeline

A Jekyll Theme, based on the Uno-Theme with some adjustments.

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sod

Site-Occupation Disorder

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WhatATheme

A customizable Jekyll Portfolio theme which supports blogging.

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