API#
Analyse set of defect entries |
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Chemical potentials definitions and calculations |
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Command line interface |
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Compute finite-size charge corrections |
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Core defect objects |
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Elastic defect properties |
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Electronic structure, density of states, carrier concentrations |
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Store data for individual defect calculation |
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Generate defect objects |
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Plotting functions for defect calculations |
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Tools for structure generation, defect identification and visualization |
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Solve charge neutrality and compute defect equilibria |
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