ECE 595E Lecture 24: Electronic Bandstructure Simulation Tools

By Peter Bermel

Electrical and Computer Engineering, Purdue University, West Lafayette, IN

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Category

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Published on

Abstract

Outline:

  • Electronic bandstructure lab
    • Basic Principles
    • Input Interface
    • Exemplary Outputs
  • Density functional theory (DFT)
  • DFT in Quantum ESPRESSO

 

Cite this work

Researchers should cite this work as follows:

  • Peter Bermel (2013), "ECE 595E Lecture 24: Electronic Bandstructure Simulation Tools," https://nanohub.org/resources/17307.

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Time

Location

EE 226, Purdue University, West Lafayette, IN

Tags

  1. band structure
  2. computational electronics
  3. course lecture
  4. density functional theory (DFT)
  5. nanoelectronics
  6. Programming
  7. Quantum ESPRESSO
  8. Simulation
ECE 595E Lecture 24: Electronic Bandstructure Simulation Tools
  • Lecture 24: Electronic Bandstructure Simulation Tools 1. Lecture 24: Electronic Bandstr… 0
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  • Recap from Monday 2. Recap from Monday 26.526526526526528
    00:00/00:00
  • Outline 3. Outline 167.1338004671338
    00:00/00:00
  • Bandstructure Lab 4. Bandstructure Lab 214.54788121454789
    00:00/00:00
  • Bandstructure Lab 5. Bandstructure Lab 329.66299632966303
    00:00/00:00
  • Bandstructure Lab: Input 6. Bandstructure Lab: Input 447.94794794794797
    00:00/00:00
  • Bandstructure Lab: Input 7. Bandstructure Lab: Input 1313.5802469135804
    00:00/00:00
  • Bandstructure Lab: Output 8. Bandstructure Lab: Output 1321.0210210210212
    00:00/00:00
  • Electronic Bandstructure Lab: 9. Electronic Bandstructure Lab: 1325.2585919252585
    00:00/00:00
  • Bandstructure Lab: Output 10. Bandstructure Lab: Output 1328.661995328662
    00:00/00:00
  • Density Functional Theory 11. Density Functional Theory 1352.0186853520188
    00:00/00:00
  • Density Functional Theory 12. Density Functional Theory 1514.8815482148816
    00:00/00:00
  • Density Functional Theory 13. Density Functional Theory 1729.2625959292627
    00:00/00:00
  • Quantum ESPRESSO: Input 14. Quantum ESPRESSO: Input 1982.2155488822157
    00:00/00:00
  • Quantum ESPRESSO: Output 15. Quantum ESPRESSO: Output 2155.121788455122
    00:00/00:00
  • Quantum ESPRESSO: Output 16. Quantum ESPRESSO: Output 2247.0136803470136
    00:00/00:00
  • Next Class 17. Next Class 2465.2986319652987
    00:00/00:00
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