24 projects
slakonet
slakonet
alignn
alignn
skalenet
SKALENET: Hybrid Slater-Koster Tight-Binding Atomsitic Line Graph Networks for Scalable Materials Design
jarvis-tools
jarvis-tools: an open-source software package for data-driven atomistic materials design. https://jarvis.nist.gov/
agapi
agapi
crystalgen
CrystalGen: Generative atomistic materials design toolkit
dmchat
Materials Science Chatbot
atomgpt
atomgpt
diffractgpt
diffractgpt
neuronlp
NeuroNLP project
chipsff
CHIPSFF: A force field analysis toolkit
jarvis-leaderboard
jarvis_leaderboard
slgnn
slgnn
slmat
ServerLess Materials Design
ifea
ifea
defectmat
defctmat
intermat
intermat
chemnlp
chemnlp
atomvision
atomvision
scigpt
scigpt
atombench
atombench
atomqc
atomqc
tb3py
tb3: an open-source software package for accurate and efficient electronic structure calculations using tight-binding (TB), including three-body interactions. https://pages.nist.gov/ThreeBodyTB.jl
qloud
qloud
