JensenPang

Member for 3 years, 6 months
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density-functional-theory

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17

How to understand the time-reversal symmetry in graphene?

Jul 21, 2020

16

Why is the band gap of graphene "opened" in this VASP calculation?

Jun 27, 2020

16

How to separate the data plot for spin up and spin down band structure into 2 different graphs, in Pymatgen?

Nov 8, 2020

15

conceptual problem about the energy band along the High symmetry point in the Brillouin zone

Jun 10, 2020

14

Calculating the Chern number on a 2D surface of a 3D insulator

Jan 20, 2021

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10

DFT vs tight-binding solutions for a Dirac cone in graphene: Why is the DFT version squeezed?

Jun 7, 2020

2

Divergence behaviour of surface energy

Apr 5, 2021

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density-functional-theory

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vasp

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band-structure

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tight-binding

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graphene

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+10

About the surface Greens function method for calculating the surface state

+10

Fermi level shift downward in the thin film structure

+20

Calculating the Chern number on a 2D surface of a 3D insulator

+10

How to calculate the parity of a band at a particular point in Brillouin zone

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