Matter Modeling
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benshi97
  • Member for 3 years, 5 months
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15
What is the difference between Ultrasoft, ONCV and PAW Pseudopotentials? Which is better for a spin-orbit coupled calculation?
Aug 13, 2020
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11
Moving from VASP to CASTEP for bulk crystal and surface calculations
Aug 4, 2020
question
7
What quantity to perform CBS extrapolation on for adsorption/binding energies?
May 19, 2021

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