Introduction to Wien2k

Let's dive into the details surrounding Wien2k. This lecture is part of an online version of the

Wien2k Comprehensive Overview

WT16: How to calculate elastic constants with WT17: How to do SCF calculation using DFT+U method with PROGRAM: STRONGLY CORRELATED SYSTEMS: FROM MODELS TO MATERIALS DATES: Monday 06 Jan, 2014 - Friday 17 ...

Learn how to initialize a

Summary & Highlights for Wien2k

  • The program package
  • Learn DFT with Muhammad — How to compute effective mass (electron & hole) from
  • WT21: How to calculate DOS (density of states) and PDOS for spin polarized system with
  • RV02: Extract key information after SCF calculation in
  • ZnO nanowire building tutorial using wien2k

That wraps up our extensive overview of Wien2k.

Wien2k.pdf

Size: 5.21 MB · Format: PDF · Secure Download

Download PDF Read Online

Related Documents