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QE Tutorial 9 | Electronic Band Structure Calculation in Quantum ESPRESSO | Graphene Example

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Dec 24, 2025
25:43

In this video, I demonstrate how to calculate the electronic band structure using Quantum ESPRESSO with graphene as a model system. The tutorial covers: Preparation of input files for band structure calculation Selection of high-symmetry k-points for graphene Self-consistent (SCF) and non-self-consistent (NSCF) calculations Post-processing and plotting of the electronic band structure Understanding the characteristic Dirac cone in graphene This tutorial is part of my Quantum ESPRESSO tutorial series and is intended for beginners and researchers working in DFT and electronic structure calculations. If you find this video helpful, don’t forget to like, share, and subscribe for more tutorials on DFT, Quantum ESPRESSO, and computational materials science. #QuantumESPRESSO #DFT #ElectronicBandStructure #Graphene #QETutorial #DensityFunctionalTheory #ComputationalPhysics #CondensedMatterPhysics #MaterialsScience #FirstPrinciples #BandStructureCalculation #GrapheneBandStructure #Linux #OpenSourceSoftware

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QE Tutorial 9 | Electronic Band Structure Calculation in Quantum ESPRESSO | Graphene Example | NatokHD