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DFT Material Properties Simulator
21 Jul 2015 | | Contributor(s):: Gustavo Javier, Usama Kamran, David M Guzman, Alejandro Strachan, Peilin Liao
Compute electronic and mechanical properties of materials from DFT calculations with 1-Click
Calculation of optical properties of Silica
Closed | Responses: 0
Can anyone please tell me how would I perform the theoretical calculation of single silica nanoparticles as well as aggregates of silica nanoaparticles.
MIT Tools for Energy Conversion and Storage
13 Sep 2009 | | Contributor(s):: Jeffrey C Grossman, Joo-Hyoung Lee, Varadharajan Srinivasan, Alexander S McLeod, Lucas Wagner
Atomic-Scale Simulation Tools to Explore Energy Conversion and Storage Materials