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Showing 1 to 1 of 1 for “"Linearized Augmented Slater-type Orbital (LASTO)"”.
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TDDFT calculations for excitation spectra of solids and superstructures utilizing mGGA
… its eigenfunctions in terms of the linear augmented-slater-type orbits(LASTO) under full potential with the exchange-correlation potential functional given by meta-generalized gradient approximation(mGGA). Our theoretical results were compared to WIEN2K’s, and good agreement was obtained. …