Tags: Time-Dependent Density Functional Theory

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  1. André Schleife

    André Schleife is a Blue Waters Associate Professor in Materials Science and Engineering. He obtained his Diploma and Ph.D. at Friedrich-Schiller-University in Jena, Germany for theoretical and...

    https://nanohub.org/members/101180

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

    Online Presentations | 31 Jan 2011 | 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 DOE-funded Research Centers at Lawrence Berkeley National Laboratory.

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

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

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

  4. 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 ab...

    https://nanohub.org/members/36238