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Ab initio determination of the crystalline benzene lattice energy to sub-kilojoule/mole accuracy

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Science  08 Aug 2014:
Vol. 345, Issue 6197, pp. 640-643
DOI: 10.1126/science.1254419

Article Information

vol. 345 no. 6197 640-643

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Print ISSN: 
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History: 
  • Received for publication April 4, 2014
  • Accepted for publication July 8, 2014
  • .

Author Information

  1. Jun Yang1,
  2. Weifeng Hu1,
  3. Denis Usvyat2,
  4. Devin Matthews3,
  5. Martin Schütz2,
  6. Garnet Kin-Lic Chan1,*
  1. 1Department of Chemistry, Princeton University, Princeton, NJ 08544, USA.
  2. 2Institut für Physikalische und Theoretische Chemie, Universität Regensburg, Regensburg D-93040, Germany.
  3. 3Department of Chemistry and Biochemistry, University of Texas at Austin, Austin, TX 078712, USA.
  1. *Corresponding author. E-mail: gkchan{at}princeton.edu

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