Keith E. Gutowski, Ph.D. - Publications

Affiliations: 
2006 The University of Alabama, Tuscaloosa, AL 
Area:
Physical Chemistry, Inorganic Chemistry

20 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2013 Jackson VE, Gutowski KE, Dixon DA. Density functional theory study of the complexation of the uranyl dication with anionic phosphate ligands with and without water molecules. The Journal of Physical Chemistry. A. 117: 8939-57. PMID 23905705 DOI: 10.1021/Jp405470K  1
2009 Gutowski KE, Gurkan B, Maginn EJ. Force field for the atomistic simulation of the properties of hydrazine, organic hydrazine derivatives, and energetic hydrazinium ionic liquids Pure and Applied Chemistry. 81: 1799-1828. DOI: 10.1351/Pac-Con-08-09-24  1
2008 Gutowski KE, Maginn EJ. Amine-functionalized task-specific ionic liquids: a mechanistic explanation for the dramatic increase in viscosity upon complexation with CO2 from molecular simulation. Journal of the American Chemical Society. 130: 14690-704. PMID 18847198 DOI: 10.1021/Ja804654B  1
2007 Gutowski KE, Rogers RD, Dixon DA. Accurate thermochemical properties for energetic materials applications. II. Heats of formation of imidazolium-, 1,2,4-triazolium-, and tetrazolium-based energetic salts from isodesmic and lattice energy calculations. The Journal of Physical Chemistry. B. 111: 4788-800. PMID 17388432 DOI: 10.1021/Jp066420D  1
2007 Gutowski KE, Cocalia VA, Griffin ST, Bridges NJ, Dixon DA, Rogers RD. Interactions of 1-methylimidazole with UO2(CH3CO2)2 and UO2(NO3)2: structural, spectroscopic, and theoretical evidence for imidazole binding to the uranyl ion. Journal of the American Chemical Society. 129: 526-36. PMID 17227015 DOI: 10.1021/Ja064592I  1
2007 Bridges NJ, Gutowski KE, Rogers RD. Investigation of aqueous biphasic systems formed from solutions of chaotropic salts with kosmotropic salts (salt-salt ABS) Green Chemistry. 9: 177-183. DOI: 10.1039/B611628K  1
2007 Reichert WM, Holbrey JD, Swatloski RP, Gutowski KE, Visser AE, Nieuwenhuyzen M, Seddon KR, Rogers RD. Solid-state analysis of low-melting 1,3-dialkylimidazolium hexafluorophosphate salts (ionic liquids) by combined X-ray crystallographic and computational analyses Crystal Growth and Design. 7: 1106-1114. DOI: 10.1021/Cg060746U  1
2006 Gutowski KE, Dixon DA. Ab initio prediction of the gas- and solution-phase acidities of strong Brønsted acids: the calculation of pKa values less than -10. The Journal of Physical Chemistry. A. 110: 12044-54. PMID 17064194 DOI: 10.1021/Jp065243D  1
2006 Gutowski KE, Rogers RD, Dixon DA. Accurate thermochemical properties for energetic materials applications. I. Heats of formation of nitrogen-containing heterocycles and energetic precursor molecules from electronic structure theory. The Journal of Physical Chemistry. A. 110: 11890-7. PMID 17048822 DOI: 10.1021/Jp0643698  1
2006 Gutowski KE, Dixon DA. Predicting the energy of the water exchange reaction and free energy of solvation for the uranyl ion in aqueous solution. The Journal of Physical Chemistry. A. 110: 8840-56. PMID 16836448 DOI: 10.1021/Jp061851H  1
2006 Cocalia VA, Holbrey JD, Gutowski KE, Bridges NJ, Rogers RD. Separations of metal ions using ionic liquids: The challenges of multiple mechanisms Tsinghua Science and Technology. 11: 188-193. DOI: 10.1016/S1007-0214(06)70174-2  1
2006 Cocalia VA, Gutowski KE, Rogers RD. The coordination chemistry of actinides in ionic liquids: A review of experiment and simulation Coordination Chemistry Reviews. 250: 755-764. DOI: 10.1016/J.Ccr.2005.09.019  1
2005 Gutowski KE, Holbrey JD, Rogers RD, Dixon DA. Prediction of the formation and stabilities of energetic salts and ionic liquids based on ab initio electronic structure calculations. The Journal of Physical Chemistry. B. 109: 23196-208. PMID 16375283 DOI: 10.1021/Jp053985L  1
2005 de Jong WA, Aprà E, Windus TL, Nichols JA, Harrison RJ, Gutowski KE, Dixon DA. Complexation of the carbonate, nitrate, and acetate anions with the uranyl dication: density functional studies with relativistic effective core potentials. The Journal of Physical Chemistry. A. 109: 11568-77. PMID 16354049 DOI: 10.1021/Jp0541462  1
2005 Gutowski KE, Holbrey JD, Rogers RD, Dixon DA. Prediction of the formation and stabilities of energetic salts and ionic liquids based on ab initio electronic structure calculations Journal of Physical Chemistry B. 109: 23196-23208. DOI: 10.1021/jp053985l  1
2005 Gutowski KE, Bridges NJ, Cocalia VA, Spear SK, Visser AE, Holbrey JD, Davis JH, Rogers RD. Ionic liquid technologies for utilization in nuclear-based separations Acs Symposium Series. 902: 33-48.  1
2004 Burns CJ, Neu MP, Boukhalfa H, Gutowski KE, Bridges NJ, Rogers RD. The Actinides Comprehensive Coordination Chemistry Ii. 3: 189-345. DOI: 10.1016/B0-08-043748-6/02001-6  1
2003 Gutowski KE, Broker GA, Willauer HD, Huddleston JG, Swatloski RP, Holbrey JD, Rogers RD. Controlling the aqueous miscibility of ionic liquids: aqueous biphasic systems of water-miscible ionic liquids and water-structuring salts for recycle, metathesis, and separations. Journal of the American Chemical Society. 125: 6632-3. PMID 12769563 DOI: 10.1021/Ja0351802  1
2003 Gutowski KE, Broker GA, Willauer HD, Huddleston JG, Swatloski RP, Holbrey JD, Rogers RD. Controlling the aqueous miscibility of ionic liquids: Aqueous biphasic systems of water-miscible ionic liquids and water-structuring salts for recycle, metathesis, and separations Journal of the American Chemical Society. 125: 6632-6633. DOI: 10.1021/ja0351802  1
2003 Gutowski KE, Bridges NJ, Cocalia VA, Spear SK, Holbrey JD, Swatloski RP, Davis JH, Rogers RD. Approaches to nuclear separations using room temperature ionic liquids Global 2003: Atoms For Prosperity: Updating Eisenhowers Global Vision For Nuclear Energy. 1604-1608.  1
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