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Geoffrey R. Hutchison, PhD - Publications

Affiliations: 
Chemistry University of Pittsburgh, Pittsburgh, PA, United States 
Area:
Chemistry
Website:
https://hutchisonlab.org/
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41 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
2021 Abarbanel OD, Hutchison GR. Machine learning to accelerate screening for Marcus reorganization energies. The Journal of Chemical Physics. 155: 054106. PMID 34364325 DOI: 10.1063/5.0059682  0.323
2020 Chan L, Hutchison GR, Morris GM. BOKEI: Bayesian optimization using knowledge of correlated torsions and expected improvement for conformer generation. Physical Chemistry Chemical Physics : Pccp. PMID 32091055 DOI: 10.1039/C9Cp06688H  0.307
2018 Ghahremanpour MM, van Maaren PJ, Caleman C, Hutchison GR, van der Spoel D. Polarizable Drude Model with s-type Gaussian or Slater Charge Density for General Molecular Mechanics Force Fields. Journal of Chemical Theory and Computation. PMID 30281307 DOI: 10.1021/Acs.Jctc.8B00430  0.432
2017 Kanal IY, Keith JA, Hutchison GR. A sobering assessment of small-molecule force field methods for low energy conformer predictions International Journal of Quantum Chemistry. 118: e25512. DOI: 10.1002/Qua.25512  0.318
2016 Moody MJ, Marvin CW, Hutchison GR. Molecularly-doped polyurethane foams with massive piezoelectric response Journal of Materials Chemistry C. 4: 4387-4392. DOI: 10.1039/C6Tc00613B  0.34
2016 Zhang S, Bauer NE, Kanal IY, You W, Hutchison GR, Meyer TY. Sequence Effects in Donor–Acceptor Oligomeric Semiconductors Comprising Benzothiadiazole and Phenylenevinylene Monomers Macromolecules. 50: 151-161. DOI: 10.1021/Acs.Macromol.6B02215  0.332
2015 Gagorik AG, Mohin JW, Kowalewski T, Hutchison GR. Effects of Delocalized Charge Carriers in Organic Solar Cells: Predicting Nanoscale Device Performance from Morphology Advanced Functional Materials. 25: 1996-2003. DOI: 10.1002/Adfm.201402332  0.813
2013 Gagorik AG, Mohin JW, Kowalewski T, Hutchison GR. Monte Carlo Simulations of Charge Transport in 2D Organic Photovoltaics. The Journal of Physical Chemistry Letters. 4: 36-42. PMID 26291208 DOI: 10.1021/Jz3016292  0.804
2013 Kanal IY, Owens SG, Bechtel JS, Hutchison GR. Efficient Computational Screening of Organic Polymer Photovoltaics. The Journal of Physical Chemistry Letters. 4: 1613-23. PMID 26282968 DOI: 10.1021/Jz400215J  0.322
2013 Gagorik AG, Mohin JW, Kowalewski T, Hutchison GR. Monte Carlo simulations of charge transport in 2D organic photovoltaics Journal of Physical Chemistry Letters. 4: 36-42. DOI: 10.1021/jz3016292  0.789
2013 Hoffmann PB, Gagorik AG, Chen X, Hutchison GR. Asymmetric surface potential energy distributions in organic electronic materials via Kelvin probe force microscopy Journal of Physical Chemistry C. 117: 18367-18374. DOI: 10.1021/Jp406781X  0.795
2013 Quan X, Marvin CW, Seebald L, Hutchison GR. Single-molecule piezoelectric deformation: Rational design from first-principles calculations Journal of Physical Chemistry C. 117: 16783-16790. DOI: 10.1021/Jp404252V  0.333
2012 Nie HJ, Chen X, Yao CJ, Zhong YW, Hutchison GR, Yao J. Electronic coupling between two amine redox sites through the 5,5'-positions of metal-chelating 2,2'-bipyridines. Chemistry (Weinheim An Der Bergstrasse, Germany). 18: 14497-509. PMID 23011958 DOI: 10.1002/Chem.201201813  0.325
2012 Gagorik AG, Hutchison GR. Simulating charge injection and dynamics in microscale organic field-effect transistors Journal of Physical Chemistry C. 116: 21232-21239. DOI: 10.1021/Jp306597N  0.782
2012 Madison TA, Gagorik AG, Hutchison GR. Charge transport in imperfect organic field effect transistors: Effects of charge traps Journal of Physical Chemistry C. 116: 11852-11858. DOI: 10.1021/Jp207421N  0.752
2011 Oboyle NM, Campbell CM, Hutchison GR. De novo design of molecular wires with optimal properties for solar energy conversion Journal of Cheminformatics. 3. DOI: 10.1186/1758-2946-3-S1-O14  0.351
2011 Madison TA, Hutchison GR. Effects of charge localization on the orbital energies of bithiophene clusters Journal of Physical Chemistry C. 115: 17558-17563. DOI: 10.1021/Jp2047085  0.783
2011 Oboyle NM, Campbell CM, Hutchison GR. Computational design and selection of optimal organic photovoltaic materials Journal of Physical Chemistry C. 115: 16200-16210. DOI: 10.1021/Jp202765C  0.347
2010 Hanwell MD, Madison TA, Hutchison GR. Charge transport in imperfect organic field effect transistors: Effects of explicit defects and electrostatics Journal of Physical Chemistry C. 114: 20417-20423. DOI: 10.1021/Jp104416A  0.79
2008 Henderson JC, Kiya Y, Hutchison GR, Abruña HD. 5,5′-bis(methylthio)-2,2′-bithiophene: A potential cathode electroactive material for energy storage devices Journal of Physical Chemistry C. 112: 3989-3997. DOI: 10.1021/Jp076774K  0.766
2007 Parks JJ, Champagne AR, Hutchison GR, Flores-Torres S, Abruña HD, Ralph DC. Tuning the Kondo effect with a mechanically controllable break junction. Physical Review Letters. 99: 026601. PMID 17678242  0.433
2007 Abruña HD, Matsumoto F, Cohen JL, Jin G, Roychowdhury C, Prochaska M, Van Bruce Dover R, Disalvo FJ, Kiya Y, Henderson JC, Hutchison GR. Electrochemical energy generation and storage. fuel cells and lithium-Ion batteries Bulletin of the Chemical Society of Japan. 80: 1843-1855. DOI: 10.1246/Bcsj.80.1843  0.765
2007 Parks JJ, Champagne AR, Hutchison GR, Flores-Torres S, Abruña HD, Ralph DC. Tuning the kondo effect with a mechanically controllable break junction Physical Review Letters. 99. DOI: 10.1103/PhysRevLett.99.026601  0.376
2007 Kiya Y, Henderson JC, Hutchison GR, Abruña HD. Synthesis, computational and electrochemical characterization of a family of functionalized dimercaptothiophenes for potential use as high-energy cathode materials for lithium/lithium-ion batteries Journal of Materials Chemistry. 17: 4366-4376. DOI: 10.1039/B707235J  0.782
2006 Kiya Y, Hutchison GR, Henderson JC, Sarukawa T, Hatozaki O, Oyama N, Abruña HD. Elucidation of the redox behavior of 2,5-dimercapto-1,3,4-thiadiazole (DMcT) at poly(3,4-ethylenedioxythiophene) (PEDOT)-modified electrodes and application of the DMcT-PEDOT composite cathodes to lithium/lithium ion batteries. Langmuir : the Acs Journal of Surfaces and Colloids. 22: 10554-63. PMID 17129030 DOI: 10.1021/La061213Q  0.762
2006 Flores-Torres S, Hutchison GR, Soltzberg LJ, Abruña HD. Ruthenium molecular wires with conjugated bridging ligands: onset of band formation in linear inorganic conjugated oligomers. Journal of the American Chemical Society. 128: 1513-22. PMID 16448121 DOI: 10.1021/Ja0552139  0.487
2005 Hutchison GR, Ratner MA, Marks TJ. Electronic structure and band gaps in cationic heterocyclic oligomers. Multidimensional analysis of the interplay of heteroatoms, substituents, molecular length, and charge on redox and transparency characteristics. The Journal of Physical Chemistry. B. 109: 3126-38. PMID 16851332 DOI: 10.1021/Jp046579V  0.574
2005 Hutchison GR, Ratner MA, Marks TJ. Intermolecular charge transfer between heterocyclic oligomers. Effects of heteroatom and molecular packing on hopping transport in organic semiconductors. Journal of the American Chemical Society. 127: 16866-81. PMID 16316233 DOI: 10.1021/Ja0533996  0.652
2005 Hutchison GR, Ratner MA, Marks TJ. Hopping transport in conductive heterocyclic oligomers: reorganization energies and substituent effects. Journal of the American Chemical Society. 127: 2339-50. PMID 15713114 DOI: 10.1021/Ja0461421  0.606
2005 Hutchison GR, Ratner MA, Marks TJ. Electronic structure and band gaps in cationic heterocyclic oligomers. Multidimensional analysis of the interplay of heteroatoms, substituents, molecular length, and charge on redox and transparency characteristics Journal of Physical Chemistry B. 109: 3126-3138. DOI: 10.1021/jp046579v  0.556
2005 Hutchison GR, Ratner MA, Marks TJ. Intermolecular charge transfer between heterocyclic oligomers. Effects of heteroatom and molecular packing on hopping transport in organic semiconductors Journal of the American Chemical Society. 127: 16866-16881. DOI: 10.1021/ja0533996  0.61
2005 Hutchison GR, Ratner MA, Marks TJ. Hopping transport in conductive heterocyclic oligomers: Reorganization energies and substituent effects Journal of the American Chemical Society. 127: 2339-2350. DOI: 10.1021/ja0461421  0.495
2004 Facchetti A, Mushrush M, Yoon MH, Hutchison GR, Ratner MA, Marks TJ. Building blocks for n-type molecular and polymeric electronics. Perfluoroalkyl- versus alkyl-functionalized oligothiophenes (nT; n = 2-6). Systematics of thin film microstructure, semiconductor performance, and modeling of majority charge injection in field-effect transistors. Journal of the American Chemical Society. 126: 13859-74. PMID 15493947 DOI: 10.1021/Ja0489846  0.771
2004 Facchetti A, Yoon MH, Stern CL, Hutchison GR, Ratner MA, Marks TJ. Building blocks for N-type molecular and polymeric electronics. Perfluoroalkyl- versus alkyl-functionalized oligothiophenes (nTs; n = 2-6). Systematic synthesis, spectroscopy, electrochemistry, and solid-state organization. Journal of the American Chemical Society. 126: 13480-501. PMID 15479105 DOI: 10.1021/Ja048988A  0.694
2004 Facchetti A, Mushrush M, Yoon MH, Hutchison GR, Ratner MA, Marks TJ. Building blocks for n-type molecular and polymeric electronics. Perfluoroalkyl- versus alkyl-functionalized oligothiophenes (nT; n = 2-6). Systematics of thin film microstructure, semiconductor performance, and modeling of majority charge injection in field-effect transistors Journal of the American Chemical Society. 126: 13859-13874. DOI: 10.1021/ja0489846  0.719
2004 Facchetti A, Hutchison GR, Keinan S, Ratner MA. Control mechanisms for transport and nonlinear optical response in organic materials: A tale of twists and barriers Inorganica Chimica Acta. 357: 3980-3990. DOI: 10.1016/J.Ica.2004.06.061  0.626
2003 Hutchison GR, Zhao Y, Delley B, Freeman AJ, Ratner MA, Marks TJ. Electronic structure of conducting polymers: Limitations of oligomer extrapolation approximations and effects of heteroatoms Physical Review B. 68. DOI: 10.1103/Physrevb.68.035204  0.539
2003 Berlin YA, Hutchison GR, Rempala P, Ratner MA, Michl J. Charge hopping in molecular wires as a sequence of electron-transfer reactions Journal of Physical Chemistry A. 107: 3970-3980. DOI: 10.1021/Jp034225I  0.559
2002 Cui J, Huang Q, Veinot JCG, Yan H, Wang Q, Hutchison GR, Richter AG, Evmenenko G, Dutta P, Marks TJ. Anode interfacial engineering approaches to enhancing anode/hole transport layer interfacial stability and charge injection efficiency in organic light-emitting diodes Langmuir. 18: 9958-9970. DOI: 10.1021/La020481V  0.724
2002 Hutchison GR, Ratner MA, Marks TJ. Accurate prediction of band gaps in neutral heterocyclic conjugated polymers Journal of Physical Chemistry A. 106: 10596-10605. DOI: 10.1021/Jp025999M  0.498
2002 Hutchison GR, Ratner MA, Marks TJ, Naaman R. Adsorption of polar molecules on a molecular surface Journal of Physical Chemistry B. 105: 2881-2884. DOI: 10.1021/Jp003282Y  0.568
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