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cond-mat2002
Third-generation muffin-tin orbitals
O. K. Andersen, T. Saha-Dasgupta, S. Ezhov
By the example of sp^3-bonded semiconductors, we illustrate what 3rd-generation muffin-tin orbitals (MTOs) are. We demonstrate that they can be downfolded to smaller and smaller ba…
cond-mat1998
Third-Generation TB-LMTO
O. K. Andersen, C. Arcangeli, R. W. Tank +4
We describe the screened Korringa-Kohn-Rostoker (KKR) method and the third-generation linear muffin-tin orbital (LMTO) method for solving the single-particle Schroedinger equation…