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exception

latest
0.7
0.4

Contents

py4vasp

Installation
Quick start

calculation

Calculation
band
bandgap
born_effective_charge
CONTCAR
density
dielectric_function
dielectric_tensor
dos
elastic_modulus
energy
fatband
force
force_constant
internal_strain
kpoint
magnetism
pair_correlation
phonon_band
phonon_dos
piezoelectric_tensor
polarization
potential
projector
stress
structure
system
topology
velocity
workfunction

raw

exception

FileAccessError
IncorrectUsage
MissingAttribute
ModuleNotInstalled
NoData
NotImplemented
OutdatedVaspVersion
ParserError
Py4VaspError
RefinementError
StopExecution

latest
0.7
0.4

get_schema¶

py4vasp.raw.get_schema()¶: Return a YAML representation of the schema.

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