siddarthachar
PhD student in Computational Modeling and Simulation
University of PittsburghPittsburgh, PA
Pinned Repositories
deepcdp
DeepCDP: Deep learning Charge Density Prediction.
protonConduction_graphanol
Documentation and discussion regarding the study of proton conduction in graphanol using deep learning potentials.
deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
dynamicDRC
Degree of rate control
dpgen
The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field
classical-MD
Classical Molecular dynamics is simpler to code efficiently, especially on C/C++. This project involves using Green-Kubo method to compute thermal conductivity of LJ Argon.
DSG_proton_conduction_DP
Files for paper on double sided graphanol
1645Project
Central Repo for the CS 1645 Group Project
dscribe
DScribe is a python package for creating machine learning descriptors for atomistic systems.
github-slideshow
A robot powered training repository :robot:
siddarthachar's Repositories
siddarthachar/starter-academic
siddarthachar/deepcdp
DeepCDP: Deep learning Charge Density Prediction.
siddarthachar/protonConduction_graphanol
Documentation and discussion regarding the study of proton conduction in graphanol using deep learning potentials.
siddarthachar/DSG_proton_conduction_DP
Files for paper on double sided graphanol
siddarthachar/dynamicDRC
Degree of rate control
siddarthachar/dscribe
DScribe is a python package for creating machine learning descriptors for atomistic systems.
siddarthachar/siddarthachar
siddarthachar/siddarthachar.github.io
Adding academic theme
siddarthachar/sidachar.github.io
siddarthachar/github-slideshow
A robot powered training repository :robot:
siddarthachar/deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
siddarthachar/classical-MD
Classical Molecular dynamics is simpler to code efficiently, especially on C/C++. This project involves using Green-Kubo method to compute thermal conductivity of LJ Argon.
siddarthachar/trixs
Toyota Research Institute X-ray Spectroscopy. Tools for machine learning of XANES.
siddarthachar/lammps
Public development project of the LAMMPS MD software package
siddarthachar/1645Project
Central Repo for the CS 1645 Group Project
siddarthachar/oppvasp
Some VASP scripts