NEMO5 Latest Version Source
19 Mar 2013 | Downloads | Contributor(s): James Fonseca, Michael Povolotskyi, Tillmann Christoph Kubis, Jean Michel D Sellier
Revision 24185 uploaded on December 16th, 2016.Revision 23455 updated on August 8th, 2016 Revision 21229 updated on Sept 2, 2015. Use this if you want to build NEMO5 from source.
Empirical Tight-binding Parameterization of SmSe in the sp3d5f7s* model
26 Mar 2013 | Downloads | Contributor(s): Zhengping Jiang, Marcelo Kuroda, Yaohua Tan, Dennis M. Newns, Michael Povolotskyi, Timothy Boykin, Tillmann Christoph Kubis, Gerhard Klimeck, Glenn J. Martyna
The Empirical Tight Binding(ETB) method is widely used in atomistic device simulations. The reliability of such simulations depends very strongly on the choice of basis sets and the ETB parameters.The Piezoelectronic Transistor (PET) has been proposed as a post-CMOS device for fast, low-power...
Graphene Layer Structure with 3% Random Silicon
02 Aug 2019 | Downloads | Contributor(s): James Charles, Sabre Kais, Tillmann Christoph Kubis
This .xyz file contains a 11,520,000 atoms structure of graphene with randomly placed Silicon. The concentration of Silicon is approximately 3%. This structure file was used to create the data in the paper "Recursive open boundary and interfaces method for material modeling, exemplified on...