QimPy
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Installing QimPy
Tutorials
Input file documentation
System
YAML template:
Component classes:
Lattice
Ions
Symmetries
Electrons
Grid
Coulomb
Geometry
Export
Parameters:
API Reference
Development
QimPy transport
QimPy
Input file documentation
System input documentation
Geometry input documentation
Dynamics input documentation
Thermostat input documentation
NVE input documentation
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NVE input documentation
Used to initialize class
qimpy.dft.geometry.thermostat.NVE
.
YAML template:
Parameters: