API tutorial
ΒΆ
1. Building a defect system
the
DefectChargeState
object
the
DefectSpecies
object
the
DOS
object
Putting it all together: the
DefectSystem
object
2. Misc.
DefectSystem
analysis
plot transition level diagrams
plot defect concentrations as a function of temperature
plot defect concentrations as a function of Fermi energy
3. Applying concentration constraints
fixing the concentrations of
DefectSpecies
fixing the concentrations of
DefectChargeStates
introducing an additional fixed concentration defect
py-sc-fermi
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API tutorial
1. Building a defect system
2. Misc.
DefectSystem
analysis
3. Applying concentration constraints
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1. Building a defect system