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SIESTA

By Lucas Wagner1, Jeffrey C Grossman2, Joe Ringgenberg3, Daniel Richards3, Alexander S McLeod4, Eric Isaacs5, Jeffrey B. Neaton5

1. Massachusetts Institute of Technology (MIT) 2. Massachusetts Institute of Technology 3. University of California, Berkeley 4. University of California - Berkeley 5. Lawrence Berkeley National Laboratory

Use SIESTA to perform electronic structure calculations

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Version 2.0.1 - published on 01 Feb 2011

doi:10.4231/D3N87300P cite this

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1076 Is there a good method for determining modes of vibration using SIESTA?
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464 How to calcualte elastic constants with this?
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