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Tags: Time-Dependent Density Functional Theory

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  1. OPV: Time Domain Ab Initio Studies of Organic-Inorganic Composites for Solar Cells

    31 Jan 2011 | Online Presentations | Contributor(s): Oleg Prezhdo

    This presentation was part of the "Organic Photovoltaics: Experiment and Theory" workshop at the 2010 Users' Meeting of the Molecular Foundry and the National Center for Electron Microscopy, both...

    http://nanohub.org/resources/10507

  2. Small Molecules in Intense Lasers via Time-Dependent Density Functional Theory

    24 Jul 2009 | Tools | Contributor(s): Marcela Meza, Daniel Lee Whitenack, Adam Wasserman

    Simulate the behavior of a hydrogen molecule when illuminated by an intense laser field.

    http://nanohub.org/resources/tddft

  3. Daniel Lee Whitenack

    I am a graduate student at Purdue University doing research in Adam Wasserman's theoretical chemistry group. The main focus of our group is to understand, improve and extend the applicability of...

    http://nanohub.org/members/36238

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