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OpenMX-deb

  1. Download a deb file of OpenMX from v3.9.9-2.
  2. Install them with apt or dpkg.
sudo apt install ./openmx_3.9.9-2_amd64.deb

openmx_3.9.9-2_amd64.deb

This is a deb file to install OpenMX 3.9.9. The default value for a input keyword of DATA.PATH is changed to /usr/share/openmx/DFT_DATA19.

  • This deb file includes a database in 2019 of fully relativistic pseudopotentials (VPS) and pseudo-atomic orbitals (PAO), which could be an input data of openmx. It is installed on /usr/share/openmx/DFT_DATA19.
  • Examples of inputs and computational results are also contained. They are installed on /usr/share/openmx/work.

Others

The deb file was prepared on Debian 11 (bullseye).