pyzfs
Spin defect simulator
Calculates ZFS tensor properties from DFT calculations of molecular and material spin defects
A python package to compute zero-field-splitting tensors for molecules and spin quantum bits in semiconductors.
11 stars
2 watching
10 forks
Language: Python
last commit: over 4 years ago
Linked from 1 awesome list
defectsdensity-functional-theorymaterials-sciencequantum-informationspin
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