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A MATLAB code for Hartree Fock calculation of H-H ground state bondlength and energy using STO-4G
08 Aug 2006 | Downloads | Contributor(s): Amritanshu Palaria
Hartree Fock (HF) theory is one of the basic theories underlying the current understanding of the electronic structure of materials. It is a simple non-relativistic treatment of many electron system …
http://nanohub.org/resources/1718
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Quantum Transport: Atom to Transistor (Spring 2004)
23 May 2006 | Courses | Contributor(s): Supriyo Datta
The development of "nanotechnology" has made it possible to engineer materials and devices on a length scale as small as several nanometers (atomic distances are ~ 0.1 nm). The properties of such …
http://nanohub.org/resources/1490
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Animations of magnetic QCA operation
21 Oct 2007 | Downloads | Contributor(s): Dmitri Nikonov
Animations of an inverter and a majority gate operation for QCA logic for the paper "Simulation of highly idealized, atomic scale MQCA logic circuits" by Dmitri E. Nikonov, George I. Bourianoff, …
http://nanohub.org/resources/3429
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Surprises on the nanoscale: Plasmonic waves that travel backward and spin birefringence without magnetic fields
08 Jan 2007 | Online Presentations | Contributor(s): Daniel Neuhauser
As nanonphotonics and nanoelectronics are pushed down towards the molecular scale, interesting effects emerge. We discuss how birefringence (different propagation of two polarizations) is …
http://nanohub.org/resources/2256
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Can numerical “experiments” INSPIRE physical experiments?
20 Dec 2007 | Online Presentations | Contributor(s): Supriyo Datta
This presentation was one of 13 presentations in the one-day forum, "Excellence in Computer Simulation," which brought together a broad set of experts to reflect on the future of computational …
http://nanohub.org/resources/3716