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Search results for julia ab initio simulations
ab-initio-simulations
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3 search results found
Deeph Pack
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161
Deep neural networks for density functional theory Hamiltonian.
Hoptb.jl
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40
Tight-binding package written in Julia
Quantumespressobase.jl
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13
Provides basic data structures and helpful functions for manipulating structures, generating input files, pre-running error checks, etc.
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