Accurate Spin-State Energetics of Transition Metal Complexes. 1. CCSD(T), CASPT2, and DFT Study of [M(NCH)6]2+ (M = Fe, Co) LM Lawson Daku, F Aquilante, TW Robinson, A Hauser Journal of chemical theory and computation 8 (11), 4216-4231, 2012 | 157 | 2012 |
Complexes of importance to the absorption of solar radiation HG Kjaergaard, TW Robinson, DL Howard, JS Daniel, JE Headrick, ... The Journal of Physical Chemistry A 107 (49), 10680-10686, 2003 | 136 | 2003 |
Calculated OH-Stretching Vibrational Transitions in the Water− Nitrogen and Water− Oxygen Complexes HG Kjaergaard, GR Low, TW Robinson, DL Howard The Journal of Physical Chemistry A 106 (38), 8955-8962, 2002 | 100 | 2002 |
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 110 (D8), 2005 | 81 | 2005 |
Vibrational overtone spectroscopy of phenol and its deuterated isotopomers S Ishiuchi, M Fujii, TW Robinson, BJ Miller, HG Kjaergaard The Journal of Physical Chemistry A 110 (23), 7345-7354, 2006 | 53 | 2006 |
Absolute intensities of CH stretching overtones in alkenes Z Rong, BR Henry, TW Robinson, HG Kjaergaard The Journal of Physical Chemistry A 109 (6), 1033-1041, 2005 | 41 | 2005 |
Calculated CH-stretching overtone spectra of naphthalene, anthracene and their cations HG Kjaergaard, TW Robinson, KA Brooking The Journal of Physical Chemistry A 104 (48), 11297-11303, 2000 | 39 | 2000 |
Calculated CH-stretching overtone spectra of naphthalene, anthracene and their cations HG Kjaergaard, TW Robinson, KA Brooking The Journal of Physical Chemistry A 104 (48), 11297-11303, 2000 | 39 | 2000 |
High level ab initio studies of the excited states of sulfuric acid and sulfur trioxide TW Robinson, DP Schofield, HG Kjaergaard The Journal of chemical physics 118 (16), 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 |
Vibrational overtone spectroscopy of jet-cooled aminophenols as a probe for rotational isomers TW Robinson, HG Kjaergaard, S Ishiuchi, M Shinozaki, M Fujii The Journal of Physical Chemistry A 108 (20), 4420-4427, 2004 | 32 | 2004 |
Environmental approaches to poverty mapping: an example from Uganda T Robinson, T Emwanu, D Rogers Information development 23 (2-3), 205-215, 2007 | 23 | 2007 |
The effect of NH 2-inversion tunneling splitting on the NH-stretching overtone spectra of aniline vapour DL Howard, TW Robinson, AE Fraser, HG Kjaergaard Physical Chemistry Chemical Physics 6 (4), 719-724, 2004 | 23 | 2004 |
High level ab initio studies of the low-lying excited states in the H2O⋅ O2 complex TW Robinson, HG Kjaergaard The Journal of chemical physics 119 (7), 3717-3720, 2003 | 22 | 2003 |
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 |
Social emotional learning: An appreciative approach to teacher development K Davis, DD Christian, R Hammett, G Low, T Seagraves-Robinson AI Practitioner 23 (3), 122-135, 2021 | 9 | 2021 |
First 12-cabinets Cray XC30 system at CSCS: Scaling and performance efficiencies of applications SR Alam, T Athanassiadou, TW Robinson, G Fourestey, A Jocksch, ... Proc. Cray User Group Conf, 1-9, 2013 | 5 | 2013 |
J. Phys. Chem. A HG Kjaergaard, TW Robinson, DL Howard, JS Daniel, JE Headrick, ... | 3 | 2003 |
Sepcial issue on high performance computing for computational science (VECPAR´ 18) Special Issue of the Cray User Group (CUG 2019) V Gil-Costa, H Senger, TW Robinson, A Thota Concurrency and Computation 32 (20), 2020 | | 2020 |