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Search results for espresso density functional theory
density-functional-theory
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espresso
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4 search results found
Qe Gpu
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45
GPU-accelerated Quantum ESPRESSO using CUDA FORTRAN
Qe Gipaw
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28
QE-GIPAW for Quantum-Espresso (official repository)
Oncvpsp
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21
Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
Bicrystal
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11
BiCrystal is a Python 3 program that builds incommensurate unit cells of bilayer materials.
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