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Questions related from Abhiyan Pandit
Dear all, 1) I am trying to calculate the elastic constants (C2D) of a 2D material by the fitting of a quadratic polynomial to a curve of energy difference (Eequ - Estr) versus strain. As...
18 February 2020 2,217 3 View
Hi, I am implementing the BoltzTraP (boltztrap-1.2.5 version) code on VASP, I got the outputs without error for the case without spin orbit coupling (SOC). But, an error 'STOP error in...
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