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Topic Title: LmtART
Topic Summary: O.K. Anderson, Max Planck Instit.. Free full-potential linear muffin-tin-orbital programs
Created On: 2/7/2007 8:52 PM

 2/7/2007 8:52 PM

Cathy Rohrer

Posts: 584
Joined: 2/6/2007

These full-potential linear muffin-tin-orbital programs are designed to perform band structure, total energy and force calculations within the methods of density functional theory. Full manual is available.

Citation: Andersen, O.K. "Welcome to Abteilung Andersen." Max Planck Institute for Solid State.

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Sample publications:
• Arita R., A. Yamasaki, K. Held, J. Matsuno, K. Kuroki, "Sr2VO4 and Ba2VO4 under pressure: An orbital switch and potential d1 superconductor," Phys. Rev. B, 75 (2007), 174521.
• Boeri L., G.B. Bachelet, M. Giantomassi, O.K. Andersen, "Electron-phonon interaction in Graphite Intercalation Compounds," Phys. Rev. B, 76 (2007), 064510.
• Kunstmann J., L. Boeri, W.E. Pickett, "Linear response separation of a solid into atomic constituents: Li, Al, and their evolution under pressure," Phys. Rev. B, 75 (2007), 075107.

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