Publications by authors named "Frank Zerilli"

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Ab initio equation of state of the organic molecular crystal: beta-octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine.
Frank J Zerilli, Maija M Kuklja

J Phys Chem A· April 2010

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Predicting C-H/pi interactions with nonlocal density functional theory.
Joe Hooper, Valentino R Cooper, Timo Thonhauser, Nichols A Romero, Frank Zerilli

Chemphyschem· April 2008

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Ab initio equation of state of an organic molecular crystal: 1,1-diamino-2,2-dinitroethylene.
Frank J Zerilli, Maija M Kuklja

J Phys Chem A· March 2007

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Ab initio studies of crystalline nitromethane under high pressure.
Frank J Zerilli, Joseph P Hooper, Maija M Kuklja

J Chem Phys· March 2007

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First principles calculation of the mechanical compression of two organic molecular crystals.
Frank J Zerilli, Maija M Kuklja

J Phys Chem A· April 2006

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Equation of state and structural changes in diaminodinitroethylene under compression.
Suhithi M Peiris, Chak P Wong, Frank J Zerilli

J Chem Phys· May 2004

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