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ABINIT
Run the community code ABINIT for electronic structure calculations under density functional theory through a convenient graphical user interface
Launch Tool
Archive Version 2.0.4
Published on 04 Mar 2010 All versions
doi:10.4231/D3CR5NC2S cite this
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Abstract
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ABINIT code, a common project of the Université Catholique de Louvain, Corning Incorporated, the Université de Liège, the Commissariat à l'Energie Atomique, Mitsubishi Chemical Corp. and the Ecole Polytechnique Palaiseau (URL http://www.abinit.org).
Credits
This work was partially funded by NSF's Network for Computational Nanotechnology.
References
[1] X. Gonze, J.-M. Beuken, R. Caracas, F. Detraux, M. Fuchs, G.-M. Rignanese, L. Sindic, M. Verstraete, G. Zerah, F. Jollet, M. Torrent, A. Roy, M. Mikami, Ph. Ghosez, J.-Y. Raty, D.C. Allan, "First-principles computation of material properties : the ABINIT software project", Computational Materials Science 25, 478-492 (2002).
[2] X. Gonze, G.-M. Rignanese, M. Verstraete, J.-M. Beuken, Y. Pouillon, R. Caracas, F. Jollet, M. Torrent, G. Zerah, M. Mikami, Ph. Ghosez, M. Veithen, J.-Y. Raty, V. Olevano, F. Bruneval, L. Reining, R. Godby, G. Onida, D.R. Hamann, and D.C. Allan, "A brief introduction to the ABINIT software package", Zeit. Kristallogr. 220, 558-562 (2005).
Cite this work
Researchers should cite this work as follows:
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If you use the simulations from this tool for publication, please cite the following in your publication: A. Palaria, X. Wang, B. Haley, M Mannino, G. Klimeck, "ABINIT on nanoHUB". Also, in the body of the paper, or in the acknowledgments, mention "The present results have been obtained through the use of the ABINIT code, a common project of the Université Catholique de Louvain, Corning Incorporated, and other contributors (URL http://www.abinit.org)"