Understanding the sensor response of metal-decorated carbon nanotubes DR Kauffman, DC Sorescu, DP Schofield, BL Allen, KD Jordan, A Star Nano letters 10 (3), 958-963, 2010 | 210 | 2010 |
Calculated OH-stretching and HOH-bending vibrational transitions in the water dimer DP Schofield, HG Kjaergaard Physical Chemistry Chemical Physics 5 (15), 3100-3105, 2003 | 140 | 2003 |
How the shape of an H-bonded network controls proton-coupled water activation in HONO formation RA Relph, TL Guasco, BM Elliott, MZ Kamrath, AB McCoy, RP Steele, ... Science 327 (5963), 308-312, 2010 | 112 | 2010 |
Infrared Measurements and Calculations on H2O⊙ HO PD Cooper, HG Kjaergaard, VS Langford, AJ McKinley, TI Quickenden, ... Journal of the American Chemical Society 125 (20), 6048-6049, 2003 | 110 | 2003 |
Hydrogen bonded OH-stretching vibration in the water dimer DP Schofield, JR Lane, HG Kjaergaard The Journal of Physical Chemistry A 111 (4), 567-572, 2007 | 96 | 2007 |
OH-and CH-stretching overtone spectra of catechol HG Kjaergaard, DL Howard, DP Schofield, TW Robinson, S Ishiuchi, ... The Journal of Physical Chemistry A 106 (2), 258-266, 2002 | 89 | 2002 |
Photolysis of sulfuric acid vapor by visible light as a source of the polar stratospheric CN layer MJ Mills, OB Toon, V Vaida, PE Hintze, HG Kjaergaard, DP Schofield, ... Journal of Geophysical Research: Atmospheres (1984–2012) 110 (D8), 2005 | 81 | 2005 |
Atmospheric water vapor complexes and the continuum JS Daniel, S Solomon, HG Kjaergaard, DP Schofield Geophysical research letters 31 (6), L06118, 2004 | 74 | 2004 |
Comparison of models with distributed polarizable sites for describing water clusters A Defusco, DP Schofield, KD Jordan Molecular Physics 105 (19-22), 2681-2696, 2007 | 61 | 2007 |
High-level ab initio studies of the electronic excited states of the hydroxyl radical and water-hydroxyl complex DP Schofield, HG Kjaergaard Journal of Chemical Physics 120 (15), 6930-6934, 2004 | 54 | 2004 |
Vibrational Spectroscopy of the Water-Nitrate Complex in the OH Stretching Region N Heine, EG Kratz, R Bergmann, D Schofield, KR Asmis, KD Jordan, ... The Journal of Physical Chemistry A, 2014 | 46 | 2014 |
Entropy-driven population distributions in a prototypical molecule with two flexible side chains: O-(2-acetamidoethyl)-N-acetyltyramine VA Shubert, EE Baquero, JR Clarkson, WH James III, JA Turk, AA Hare, ... The Journal of chemical physics 127, 234315, 2007 | 42 | 2007 |
The lowest A′ 2 excited state of the water-hydroxyl complex TD Crawford, ML Abrams, RA King, JR Lane, DP Schofield, ... The Journal of chemical physics 125 (20), 204302, 2006 | 38 | 2006 |
High level ab initio studies of the excited states of sulfuric acid and sulfur trioxide TW Robinson, DP Schofield, HG Kjaergaard Journal of Chemical Physics 118, 7226-7232, 2003 | 36 | 2003 |
Infrared Identification of Matrix Isolated H2O⊙ O2 PD Cooper, HG Kjaergaard, VS Langford, AJ McKinley, TI Quickenden, ... The Journal of Physical Chemistry A 109 (19), 4274-4279, 2005 | 33 | 2005 |
The OH-stretching and OOH-bending overtone spectrum of HOONO DP Schofield, HG Kjaergaard, J Matthews, A Sinha The Journal of chemical physics 123, 134318, 2005 | 28 | 2005 |
Molecular Dynamics Simulations of Bromine Clathrate Hydrates† DP Schofield, KD Jordan The Journal of Physical Chemistry A 113 (26), 7431-7438, 2009 | 22 | 2009 |
Atmospheric Photolysis of Sulfuric Acid HG Kjaergaard, JR Lane, AL Garden, DP Schofield, TW Robinson, ... Advances in Quantum Chemistry 55, 137-158, 2008 | 19 | 2008 |
Effect of OH internal torsion on the OH-stretching spectrum of cis, cis-HOONO DP Schofield, HG Kjaergaard The Journal of Physical Chemistry A 109 (9), 1810-1814, 2005 | 17 | 2005 |
CH-stretching overtone spectra of 3-hexyne and butane BR Henry, DM Turnbull, DP Schofield, HG Kjaergaard The Journal of Physical Chemistry A 107 (18), 3236-3243, 2003 | 15 | 2003 |