Correlating Experimental Photophysical Properties of Iridium(III) Complexes to Spin–Orbit Coupled TDDFT Predictions von Younker, Jarod M, Dobbs, Kerwin D

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Structure and Dynamics of Octamethyl-POSS Nanoparticles von Jalarvo, Niina, Gourdon, Olivier, Ehlers, Georg, Tyagi, Madhusudan, Kumar, Sanat K, Dobbs, Kerwin D, Smalley, Robert J, Guise, William E, Ramirez-Cuesta, Anibal, Wildgruber, Christoph, Crawford, Michael K

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2,6-Bis[2-(4-pentylphenyl)vinyl]anthracene:  A Stable and High Charge Mobility Organic Semiconductor with Densely Packed Crystal Structure von Meng, Hong, Sun, Fangping, Goldfinger, Marc B, Gao, Feng, Londono, David J, Marshal, Will J, Blackman, Greg S, Dobbs, Kerwin D, Keys, Dalen E

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Phosphorescent Iridium(III) Complexes of Cyclometalated 5‑Aryl‑1H‑1,2,4-Triazole Ligands: Structural, Computational, Spectroscopic, and Device Studies von Dobbs, Kerwin D, Feldman, Jerald, Marshall, Will J, McLain, Stephan J, McLaren, Charles D, Meth, Jeffrey S, Vo, Giang D, Wang, Ying

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Why excess cyanide can be detrimental to Pd-catalyzed cyanation of haloarenes. Facile formation and characterization of [Pd(CN)(3)(H)](2-) and [Pd(CN)(3)(Ph)](2-) von Dobbs, Kerwin D, Marshall, William J, Grushin, Vladimir V

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Highly Quantum Efficient Phosphorescent Sky Blue Emitters Based on Diastereomeric Iridium(III) Complexes of Atropisomeric 5‑Aryl‑4H‑1,2,4-triazole Ligands von Feldman, Jerald, Vo, Giang D, McLaren, Charles D, Gehret, Troy C, Park, Kyung-Ho, Meth, Jeffrey S, Marshall, Will J, Buriak, Joseph, Bryman, Lois M, Dobbs, Kerwin D, Scholz, Thomas H, Zane, Steve G

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Atmospheric Chemistry of Linear Perfluorinated Aldehydes:  Dissociation Kinetics of CnF2n+1CO Radicals von WATERLAND, Robert L., DOBBS, Kerwin D.

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2-Phenylpyridine:  To Twist or Not To Twist? von Dobbs, Kerwin D, Sohlberg, Karl

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A local density functional study of the structure and vibrational frequencies of molecular transition-metal compounds von Sosa, Carlos, Andzelm, Jan, Elkin, Brad C, Wimmer, Erich, Dobbs, Kerwin D, Dixon, David A

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The fourth industrial fluid properties simulation challenge von Case, Fiona H., Brennan, John, Chaka, Anne, Dobbs, Kerwin D., Friend, Daniel G., Gordon, Peter A., Moore, Jonathan D., Mountain, Raymond D., Olson, James D., Ross, Richard B., Schiller, Martin, Shen, Vincent K., Stahlberg, Eric A.

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Copper(I) Complexes with Bis(trimethylsilyl)acetylene:  Role of Ancillary Ligands in Determining π Back-Bonding Interactions von Thompson, Jeffery S, Bradley, Alexander Z, Park, Kyung-Ho, Dobbs, Kerwin D, Marshall, Will

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The third industrial fluid properties simulation challenge von Case, Fiona H., Brennan, John, Chaka, Anne, Dobbs, Kerwin D., Friend, Daniel G., Frurip, David, Gordon, Peter A., Moore, Jonathan, Mountain, Raymond D., Olson, James, Ross, Richard B., Schiller, Martin, Shen, Vincent K.

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Why Excess Cyanide Can Be Detrimental to Pd-Catalyzed Cyanation of Haloarenes. Facile Formation and Characterization of [Pd(CN)3(H)]2- and [Pd(CN)3(Ph)]2 von Dobbs, Kerwin D, Marshall, William J, Grushin, Vladimir V

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Computational Characterization of Metal Binding Groups for Metalloenzyme Inhibitors von Dobbs, Kerwin D, Rinehart, Amy M, Howard, Michael H, Zheng, Ya-Jun, Kleier, Daniel A

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Phosphorescent Iridium(III) Complexes of Cyclometalated 5-Aryl-1 H -1,2,4-Triazole Ligands: Structural, Computational, Spectroscopic, and Device Studies von Dobbs, Kerwin D., Feldman, Jerald, Marshall, Will J., McLain, Stephan J., McLaren, Charles D., Meth, Jeffrey S., Vo, Giang D., Wang, Ying

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Quantum chemical modeling for 157 nm photolithography von Waterland, Robert L, Dobbs, Kerwin D, Rinehart, Amy M, Feiring, Andrew E, Wheland, Robert C, Smart, Bruce E

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Highly Quantum Efficient Phosphorescent Sky Blue Emitters Based on Diastereomeric Iridium(III) Complexes of Atropisomeric 5-Aryl-4 H -1,2,4-triazole Ligands von Feldman, Jerald, Vo, Giang D., McLaren, Charles D., Gehret, Troy C., Park, Kyung-Ho, Meth, Jeffrey S., Marshall, Will J., Buriak, Joseph, Bryman, Lois M., Dobbs, Kerwin D., Scholz, Thomas H., Zane, Steve G.

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Prediction of Infrared Intensities by Using Density Functional Theory. Applications to H2O, HOO, CH4, and C2H4 von Dobbs, Kerwin D, Dixon, David A

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A Raman Spectroscopy Study of the Separation of Hydrofluorocarbons Using Zeolites von Crawford, Michael K, Dobbs, Kerwin D, Smalley, Robert J, Corbin, David R, Maliszewskyj, Nicholas, Udovic, Terrence J, Cavanagh, Richard R, Rush, John J, Grey, Clare P

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Reply to “Comment on ‘Atmospheric Chemistry of Linear Perfluorinated Aldehydes:  Dissociation Kinetics of CnF2n+1CO Radicals'” von WATERLAND, Robert L., DOBBS, Kerwin D.

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