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Topic: "self-consistent-field"

ChASE-library/ChASE

This repository mirrors the principal Gitlab repository of the Chebyshev Accelerated Subspace iteration Eigensolver. If you want to contribute as developer to this project please contact [email protected].

Language: C++ - Size: 15.8 MB - Last synced at: 15 days ago - Pushed at: 15 days ago - Stars: 17 - Forks: 6

Dirac4pi/TRESC

Thomas Relativistic Electronic Structure Calculation

Language: Fortran - Size: 71.7 MB - Last synced at: 3 days ago - Pushed at: 3 days ago - Stars: 7 - Forks: 0

mfherbst/SelfConsistentField.jl 📦

A Julia toolbox for coding self-consistent field algorithms

Language: Julia - Size: 244 KB - Last synced at: over 1 year ago - Pushed at: over 5 years ago - Stars: 4 - Forks: 1

bangconghuynh/mqm2019poster

MQM2019 Poster

Language: TeX - Size: 23.5 MB - Last synced at: 4 months ago - Pushed at: almost 6 years ago - Stars: 4 - Forks: 0

molsturm/gscf 📦

A general library for solving self-consistent field problems

Language: C++ - Size: 310 KB - Last synced at: over 1 year ago - Pushed at: over 6 years ago - Stars: 4 - Forks: 1

huangli712/Dyson

Dyson's equation solver for the Zen computation framework

Language: Fortran - Size: 318 KB - Last synced at: 28 days ago - Pushed at: 28 days ago - Stars: 0 - Forks: 0

chinchay/GreenPy

Decimation of the Green function in graphene nanoribbons

Language: Python - Size: 573 KB - Last synced at: about 2 years ago - Pushed at: over 2 years ago - Stars: 0 - Forks: 0