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Search results for density functional theory pseudopotentials
density-functional-theory
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pseudopotentials
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4 search results found
Sirius
⭐
112
Domain specific library for electronic structure calculations
Pwdft.jl
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104
Plane wave density functional theory using Julia programming language
Pslibrary
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46
A library of ultrasoft and PAW pseudopotentials
Oncvpsp
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21
Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
Pstudio
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7
Pseudopotential Studio
Pseudopotentialio.jl
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6
Support for reading and using pseudopotentials in Julia
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1-4 of 4 search results
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