DFTpy
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Installation
Tutorials
Config of DFTpy script
Script mode of DFTpy
OFDFT
Optimization of Density
Relaxation of Structure
Molecular Dynamics Simulation
TDDFT
Use of Propagator
Do it on a Jupyter Notebook!
Density Optimization
TD-OFDFT
Stable releases
DFTpy
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Config of DFTpy script
¶
Script mode of DFTpy
OFDFT
¶
Optimization of Density
Relaxation of Structure
Molecular Dynamics Simulation
TDDFT
¶
Use of Propagator
Do it on a Jupyter Notebook!
¶
Density Optimization
TD-OFDFT