WORKSHOP WFS |

Schedule

Wavefunction methods for solid state matter

Schedule

  • Day 1 (Monday – 23.03)
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  • Day 2 (Tuesday – 24.03)
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  • Day 3 (Wednesday – 25.03)
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  • Day 4 (Thursday – 26.03)
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  • Day 5 (Friday – 27.03)
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Notes

  • During the workshop we will use some computational software, which does not require any installation. However, some graphical tools works much better if you have them
    on your laptop. During the first evening it will be possible to get some help from the teachers with installation, but we recommend you to install by yourself the necessary   software prior the workshop.
    1. VESTA
      You need this code for visualization during the second day of the workshop.
      Follow the download instructions
      https://jp-minerals.org/vesta/en/download.html
      To verify the installation – download
      https://jp-minerals.org/vesta/archives/VESTA-Examples.zip
      Find any file with extension .cif and open it with vesta.
    2. LUSCUS/GV
      You need this code for visualization during the third day of the workshop.
      LUSCUS is a more user friendly version of GV, but it requires more libraries for
      the installation. You need to install only one of these codes.
      To get the code, download it from:
      https://www.molcas.org/GV/
      https://sourceforge.net/projects/luscus/Note for MacOS users: unless you use ‘port’ package manager, don’t try
      to install LUSCUS, it is not compatible with Homebrew.To verify GV/LUSCUS installation – download
      www.molcas.org/GV/TEST/2water.lus
      and open it with gv or luscus.If all means to install GV/LUSCUS – fail, please, try to install any code
      for visualization of Gaussian Cube files.