Author Topic: Software  (Read 3202 times)

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Offline Jahanzaib

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Software
« on: December 14, 2022, 02:41 »
Hello
I have quick question: for bulk configuration - NonuniformGridConjugateGradientSolver and fast fourier solver are the best. I am having a system where I am using stanene nanoribbons and cluster on it (bulk configuration). How to choose Solver in this case?

How to calculate integrated DOS in quantumatk? or how to get an idea of molecular orbitals in bulk and device configurations?

Thank you
« Last Edit: January 10, 2023, 12:35 by Jahanzaib »