Approximate DFT methods for extended systems (June 20-21, 2016)

Current group member (April 2015)

Group Picture

 

Schedule

Presentation files

To download the PDF files on this page, enter userid: qcguest and the password provided in the workshop.

  • Stephan Irle (Nagoya University): Introduction to DFTB: Approximate DFT methods for extended systems (PDF)
  • Dmitri Fedorov (AIST, Tsukuba): Introduction to the Fragment Molecular Orbital Approaches (PDF)
  • Yoshio Nishimoto (Fukui Institute, Kyoto University): Implementation of DFTB and FMO-DFTB and PCM in GAMESS (PDF)
  • Udo Schnupf (Bradley University, Peoria): The complexities of sugars (PDF)
  • TUTORIAL by Yoshio Nishimoto (Fukui Institute, Kyoto University): Using DFTB and FMO-DFTB on HAWK Computer System at Nagoya University (PDF)

Photo galery


From DFTB mini workshop 2016. Posted by Irle QC on 6/23/2016 (50 items)

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