MARMOT: magnetism, anisotropy, and more, using the relativistic disordered local moment picture at finite temperature
We present MARMOT, a hybrid Python/FORTRAN implementation of the disordered local moment picture within multiple scattering density-functional theory. MARMOT takes atom-centred, scalar-relativistic potentials and constructs an effective medium (within the coherent potential approximation) to describe...
| Հիմնական հեղինակներ: | , |
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| Ձևաչափ: | Journal article |
| Լեզու: | English |
| Հրապարակվել է: |
IOP Science
2022
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