Stephen Kevin Gray - Publications

Affiliations: 
Center for Nanoscale Materials Argonne National Laboratory, Lemont, IL, United States 
Area:
Theoretical Chemistry, Nanophontonics, Plasmonics
Website:
http://chmwls.chm.anl.gov/staff/chem-dyn/gray.html

120 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
2024 Hodgins HP, Foley JJ, Govorov AO, Gray SK, Hamilton IP. Emergence of a Low-Energy Peak in the Smoothed Absolute Value Circular Dichroism Spectra of Small Helical Gold Nanorods. Acs Omega. 9: 5224-5229. PMID 38343910 DOI: 10.1021/acsomega.3c04943  0.526
2020 Yadav RK, Otten M, Wang W, Cortes CL, Gosztola DJ, Wiederrecht GP, Gray SK, Odom TW, Basu JK. Strongly coupled exciton - surface lattice resonances engineer long-range energy propagation. Nano Letters. PMID 32470309 DOI: 10.1021/Acs.Nanolett.0C01236  0.376
2019 Jeon N, Mandia DJ, Gray SK, Foley JJ, Martinson ABF. High-Temperature Selective Emitter Design and Materials: Titanium Aluminum Nitride Alloys for Thermophotovoltaics. Acs Applied Materials & Interfaces. PMID 31652047 DOI: 10.1021/Acsami.9B13944  0.547
2019 Chang L, Besteiro LV, Sun J, Santiago EY, Gray SK, Wang Z, Govorov AO. Electronic Structure of the Plasmons in Metal Nanocrystals: Fundamental Limitations for the Energy Efficiency of Hot Electron Generation Acs Energy Letters. 4: 2552-2568. DOI: 10.1021/Acsenergylett.9B01617  0.329
2018 Yifat Y, Coursault D, Peterson CW, Parker J, Bao Y, Gray SK, Rice SA, Scherer NF. Reactive optical matter: light-induced motility in electrodynamically asymmetric nanoscale scatterers. Light, Science & Applications. 7: 105. PMID 30564311 DOI: 10.1038/S41377-018-0105-Y  0.326
2018 Heilpern T, Manjare M, Govorov AO, Wiederrecht GP, Gray SK, Harutyunyan H. Determination of hot carrier energy distributions from inversion of ultrafast pump-probe reflectivity measurements. Nature Communications. 9: 1853. PMID 29748626 DOI: 10.1038/S41467-018-04289-3  0.314
2018 Gupta MC, Ungaro C, Foley JJ, Gray SK. Optical nanostructures design, fabrication, and applications for solar/thermal energy conversion Solar Energy. 165: 100-114. DOI: 10.1016/J.Solener.2018.01.010  0.587
2017 Thomas R, Thomas A, Pullanchery S, Joseph L, Somasundaran SM, Swathi RS, Gray SK, Thomas KG. Plexcitons: The Role of Oscillator Strengths and Spectral Widths in Determining Strong Coupling. Acs Nano. PMID 29261287 DOI: 10.1021/Acsnano.7B06589  0.32
2017 Vasista A, Jog H, Heilpern T, Sykes ME, Tiwari S, Sharma DK, Chaubey SK, Wiederrecht GP, Gray SK, Kumar GVP. Differential Wavevector Distribution of Surface-Enhanced Raman Scattering and Fluorescence in a Film-Coupled Plasmonic Nanowire Cavity. Nano Letters. PMID 29244518 DOI: 10.1021/Acs.Nanolett.7B05080  0.35
2017 Kang S, Lehman SE, Schulmerich MV, Le AP, Lee TW, Gray SK, Bhargava R, Nuzzo RG. Refractive index sensing and surface-enhanced Raman spectroscopy using silver-gold layered bimetallic plasmonic crystals. Beilstein Journal of Nanotechnology. 8: 2492-2503. PMID 29234585 DOI: 10.3762/Bjnano.8.249  0.324
2017 Narayanan B, Chan H, Kinaci A, Sen FG, Gray SK, Chan MKY, Sankaranarayanan SKRS. Machine learnt bond order potential to model metal-organic (Co-C) heterostructures. Nanoscale. PMID 29043353 DOI: 10.1039/C7Nr06038F  0.323
2017 Ma X, Diroll BT, Fedin I, Cho W, Schaller RD, Talapin DV, Gray SK, Wiederrecht GP, Gosztola DJ. Size-Dependent Biexciton Quantum Yields and Carrier Dynamics of Quasi-Two-Dimensional Core/Shell Nanoplatelets. Acs Nano. PMID 28787569 DOI: 10.1021/Acsnano.7B03943  0.315
2017 Figliozzi P, Sule N, Yan Z, Bao Y, Burov S, Gray SK, Rice SA, Vaikuntanathan S, Scherer NF. Driven optical matter: Dynamics of electrodynamically coupled nanoparticles in an optical ring vortex. Physical Review. E. 95: 022604. PMID 28298004 DOI: 10.1103/Physreve.95.022604  0.451
2017 Hensen M, Heilpern T, Gray SK, Pfeiffer W. Strong Coupling and Entanglement of Quantum Emitters Embedded in a Nanoantenna-Enhanced Plasmonic Cavity Acs Photonics. 5: 240-248. DOI: 10.1021/Acsphotonics.7B00717  0.338
2017 Ridgway HF, Orbell J, Gray S. Molecular simulations of polyamide membrane materials used in desalination and water reuse applications: Recent developments and future prospects Journal of Membrane Science. 524: 436-448. DOI: 10.1016/J.Memsci.2016.11.061  0.307
2016 Fei Z, Foley JJ, Gannett W, Liu MK, Dai S, Ni GX, Zettl A, Fogler MM, Wiederrecht GP, Gray SK, Basov DN. Ultraconfined Plasmonic Hotspots Inside Graphene Nanobubbles. Nano Letters. 16: 7842-7848. PMID 27960518 DOI: 10.1021/Acs.Nanolett.6B04076  0.514
2016 Fei Z, Scott ME, Gosztola DJ, Foley JJ, Yan J, Mandrus DG, Wen H, Zhou P, Zhang DW, Sun Y, Guest JR, Gray SK, Bao W, Wiederrecht GP, Xu X. Nano-optical imaging of WS e2 waveguide modes revealing light-exciton interactions Physical Review B - Condensed Matter and Materials Physics. 94. DOI: 10.1103/Physrevb.94.081402  0.537
2016 Zhang N, Han C, Xu YJ, Foley JJ, Zhang D, Codrington J, Gray SK, Sun Y. Near-field dielectric scattering promotes optical absorption by platinum nanoparticles Nature Photonics. DOI: 10.1038/Nphoton.2016.76  0.552
2016 Narayanan B, Kinaci A, Sen FG, Davis MJ, Gray SK, Chan MKY, Sankaranarayanan SKRS. Describing the Diverse Geometries of Gold from Nanoclusters to Bulk - A First-Principles-Based Hybrid Bond-Order Potential Journal of Physical Chemistry C. 120: 13787-13800. DOI: 10.1021/Acs.Jpcc.6B02934  0.303
2015 Foley JJ, Ungaro C, Sun K, Gupta MC, Gray SK. Design of emitter structures based on resonant perfect absorption for thermophotovoltaic applications. Optics Express. 23: A1373-87. PMID 26698788 DOI: 10.1364/Oe.23.0A1373  0.578
2015 Sule N, Rice SA, Gray SK, Scherer NF. An electrodynamics-Langevin dynamics (ED-LD) approach to simulate metal nanoparticle interactions and motion. Optics Express. 23: 29978-92. PMID 26698479 DOI: 10.1364/Oe.23.029978  0.382
2015 Pelzer KM, Darling SB, Gray SK, Schaller RD. Exciton size and quantum transport in nanoplatelets. The Journal of Chemical Physics. 143: 224106. PMID 26671357 DOI: 10.1063/1.4936407  0.307
2015 Li Z, Foley JJ, Peng S, Sun CJ, Ren Y, Wiederrecht GP, Gray SK, Sun Y. Reversible Modulation of Surface Plasmons in Gold Nanoparticles Enabled by Surface Redox Chemistry. Angewandte Chemie (International Ed. in English). 54: 8948-51. PMID 26094976 DOI: 10.1002/Anie.201502012  0.53
2015 Li Z, Foley JJ, Peng S, Sun CJ, Ren Y, Wiederrecht GP, Gray SK, Sun Y. Reversible Modulation of Surface Plasmons in Gold Nanoparticles Enabled by Surface Redox Chemistry. Angewandte Chemie (International Ed. in English). 54: 8948-51. PMID 26094976 DOI: 10.1002/Anie.201502012  0.53
2015 Foley JJ, Harutyunyan H, Rosenmann D, Divan R, Wiederrecht GP, Gray SK. When are surface plasmon polaritons excited in the Kretschmann-Raether configuration? Scientific Reports. 5: 9929. PMID 25905685 DOI: 10.1038/Srep09929  0.545
2015 Foley JJ, Harutyunyan H, Rosenmann D, Divan R, Wiederrecht GP, Gray SK. When are surface plasmon polaritons excited in the Kretschmann-Raether configuration? Scientific Reports. 5: 9929. PMID 25905685 DOI: 10.1038/Srep09929  0.545
2015 Foley JJ, Ungaro C, Sun K, Gupta MC, Gray SK. Design of emitter structures based on resonant perfect absorption for thermophotovoltaic applications Optics Express. 23: A1373-A1387. DOI: 10.1364/OE.23.0A1373  0.51
2014 Bachelot R, Zhou X, Plain J, Adam PM, Baudrion AL, Gray SK, Wiederrecht GP. Local energy transfer in hybrid nanoplasmonics Proceedings of Spie - the International Society For Optical Engineering. 9126. DOI: 10.1117/12.2053716  0.349
2014 Zhou X, Soppera O, Plain J, Jradi S, Wei Sun X, Volkan Demir H, Yang X, Deeb C, Gray SK, Wiederrecht GP, Bachelot R. Plasmon-based photopolymerization: Near-field probing, advanced photonic nanostructures and nanophotochemistry Journal of Optics (United Kingdom). 16. DOI: 10.1088/2040-8978/16/11/114002  0.347
2014 Foley JJ, McMahon JM, Schatz GC, Harutyunyan H, Wiederrecht GP, Gray SK. Inhomogeneous Surface Plasmon Polaritons Acs Photonics. 1: 739-745. DOI: 10.1021/Ph500172F  0.544
2014 Foley JJ, McMahon JM, Schatz GC, Harutyunyan H, Wiederrecht GP, Gray SK. Inhomogeneous Surface Plasmon Polaritons Acs Photonics. 1: 739-745. DOI: 10.1021/Ph500172F  0.544
2014 Dumée LF, Allioux F, Reis R, Duke M, Gray S, Tobin M, Puskar L, He L, Hodgson P, Kong L. Qualitative spectroscopic characterization of the matrix–silane coupling agent interface across metal fibre reinforced ion exchange resin composite membranes Vibrational Spectroscopy. 75: 203-212. DOI: 10.1016/J.Vibspec.2014.05.011  0.305
2014 Palacios E, Chen A, Foley J, Gray SK, Welp U, Rosenmann D, Vlasko-Vlasov VK. Ultra-confined modes in metal nanoparticle arrays for subwavelength light guiding and amplification Advanced Optical Materials. 2: 394-399. DOI: 10.1002/Adom.201300523  0.595
2013 Sun Y, Foley JJ, Peng S, Li Z, Gray SK. Interfaced metal heterodimers in the quantum size regime. Nano Letters. 13: 3958-64. PMID 23879377 DOI: 10.1021/Nl402361B  0.611
2013 Chen A, Miller RL, DePrince AE, Joshi-Imre A, Shevchenko E, Ocola LE, Gray SK, Welp U, Vlasko-Vlasov VK. Plasmonic amplifiers: engineering giant light enhancements by tuning resonances in multiscale plasmonic nanostructures. Small (Weinheim An Der Bergstrasse, Germany). 9: 1939-46. PMID 23281210 DOI: 10.1002/Smll.201202216  0.344
2013 Shah RA, Scherer NF, Pelton M, Gray SK. Ultrafast reversal of a Fano resonance in a plasmon-exciton system Physical Review B - Condensed Matter and Materials Physics. 88. DOI: 10.1103/Physrevb.88.075411  0.352
2013 Dumée LF, He L, Lin B, Ailloux F, Lemoine J, Velleman L, She F, Duke MC, Orbell JD, Erskine G, Hodgson PD, Gray S, Kong L. The fabrication and surface functionalization of porous metal frameworks – a review Journal of Materials Chemistry. 1: 15185-15206. DOI: 10.1039/C3Ta13240D  0.304
2013 Sun Y, Foley JJ, Peng S, Li Z, Gray SK. Interfaced metal heterodimers in the quantum size regime Nano Letters. 13: 3958-3964. DOI: 10.1021/nl402361b  0.521
2013 Gray SK. Theory and modeling of plasmonic structures Journal of Physical Chemistry C. 117: 1983-1994. DOI: 10.1021/Jp309664C  0.376
2011 DePrince AE, Pelton M, Guest JR, Gray SK. Emergence of excited-state plasmon modes in linear hydrogen chains from time-dependent quantum mechanical methods. Physical Review Letters. 107: 196806. PMID 22181635 DOI: 10.1103/Physrevlett.107.196806  0.321
2011 Guffey MJ, Miller RL, Gray SK, Scherer NF. Plasmon-driven selective deposition of au bipyramidal nanoparticles. Nano Letters. 11: 4058-66. PMID 21902194 DOI: 10.1021/Nl201020G  0.325
2011 Sun Y, Gray SK, Peng S. Surface chemistry: a non-negligible parameter in determining optical properties of small colloidal metal nanoparticles. Physical Chemistry Chemical Physics : Pccp. 13: 11814-26. PMID 21611673 DOI: 10.1039/C1Cp20265K  0.352
2011 Ratchford D, Shafiei F, Kim S, Gray SK, Li X. Manipulating coupling between a single semiconductor quantum dot and single gold nanoparticle. Nano Letters. 11: 1049-54. PMID 21280639 DOI: 10.1021/Nl103906F  0.326
2011 McMahon JM, Gray SK, Schatz GC. Fundamental behavior of electric field enhancements in the gaps between closely spaced nanostructures Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.115428  0.311
2010 Lee TW, Gray SK. Remote grating-assisted excitation of narrow-band surface plasmons. Optics Express. 18: 23857-64. PMID 21164730 DOI: 10.1364/Oe.18.023857  0.332
2010 Wu X, Gray SK, Pelton M. Quantum-dot-induced transparency in a nanoscale plasmonic resonator. Optics Express. 18: 23633-45. PMID 21164708 DOI: 10.1364/Oe.18.023633  0.357
2010 McMahon JM, Gray SK, Schatz GC. Optical properties of nanowire dimers with a spatially nonlocal dielectric function. Nano Letters. 10: 3473-81. PMID 20715807 DOI: 10.1021/Nl101606J  0.348
2010 Chowdhury MH, Ray K, Gray SK, Pond J, Lakowicz JR. The use of aluminum nanostructures as platforms for metal enhanced fluorescence of the intrinsic emission of biomolecules in the ultra-violet. Proceedings of Spie--the International Society For Optical Engineering. 7577: 75770O. PMID 20706552 DOI: 10.1117/12.841449  0.305
2010 Cao L, Nome RA, Montgomery JM, Gray SK, Scherer NF. Controlling plasmonic wave packets in silver nanowires. Nano Letters. 10: 3389-94. PMID 20704322 DOI: 10.1021/Nl101285T  0.333
2010 Yao J, Le AP, Gray SK, Moore JS, Rogers JA, Nuzzo RG. Functional nanostructured plasmonic materials. Advanced Materials (Deerfield Beach, Fla.). 22: 1102-10. PMID 20401934 DOI: 10.1002/Adma.200904097  0.327
2010 McMahon JM, Gray SK, Schatz GC. Calculating nonlocal optical properties of structures with arbitrary shape Physical Review B - Condensed Matter and Materials Physics. 82. DOI: 10.1103/Physrevb.82.035423  0.337
2010 Juan ML, Plain J, Bachelot R, Royer P, Gray SK, Wiederrecht GP. Self-consistent model of light-induced molecular motion around metallic nanostructures Journal of Physical Chemistry Letters. 1: 2228-2232. DOI: 10.1021/Jz100754C  0.328
2010 McMahon JM, Gray SK, Schatz GC. Nonlocal dielectric effects in core-shell nanowires Journal of Physical Chemistry C. 114: 15903-15908. DOI: 10.1021/Jp910899B  0.348
2009 Montgomery JM, Imre A, Welp U, Vlasko-Vlasov V, Gray SK. SERS enhancements via periodic arrays of gold nanoparticles on silver film structures. Optics Express. 17: 8669-75. PMID 19434200 DOI: 10.1364/Oe.17.008669  0.327
2009 Nome RA, Guffey MJ, Scherer NF, Gray SK. Plasmonic interactions and optical forces between au bipyramidal nanoparticle dimers. The Journal of Physical Chemistry. A. 113: 4408-15. PMID 19267445 DOI: 10.1021/Jp811068J  0.335
2009 Babayan Y, McMahon JM, Li S, Gray SK, Schatz GC, Odom TW. Confining standing waves in optical corrals. Acs Nano. 3: 615-20. PMID 19243190 DOI: 10.1021/Nn8008596  0.315
2009 Zhang M, Gray SK, Rice SA. Quantum localization due to mirror plane symmetry Physical Review a - Atomic, Molecular, and Optical Physics. 80. DOI: 10.1103/Physreva.80.012107  0.445
2008 Chowdhury MH, Pond J, Gray SK, Lakowicz JR. Systematic Computational Study of the Effect of Silver Nanoparticle Dimers on the Coupled Emission from Nearby Fluorophores. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 112: 11236-11249. PMID 19777130 DOI: 10.1021/Jp802414K  0.322
2008 Zhang M, Harding LB, Gray SK, Rice SA. Quantum states of the endohedral fullerene Li@C60. The Journal of Physical Chemistry. A. 112: 5478-85. PMID 18491877 DOI: 10.1021/Jp801083M  0.443
2008 Montgomery JM, Gray SK. Enhancing surface plasmon polariton propagation lengths via coupling to asymmetric waveguide structures Physical Review B - Condensed Matter and Materials Physics. 77. DOI: 10.1103/Physrevb.77.125407  0.336
2008 Montgomery JM, Lee TW, Gray SK. Theory and modeling of light interactions with metallic nanostructures Journal of Physics Condensed Matter. 20. DOI: 10.1088/0953-8984/20/32/323201  0.332
2008 Hubert C, Bachelot R, Plain J, Kostcheev S, Lerondel G, Juan M, Royer P, Zou S, Schatz GC, Wiederrecht GP, Gray SK. Near-field polarization effects in molecular-motion-induced photochemical imaging Journal of Physical Chemistry C. 112: 4111-4116. DOI: 10.1021/Jp7096263  0.3
2007 Chowdhury MH, Gray SK, Pond J, Geddes CD, Aslan K, Lakowicz JR. Computational study of fluorescence scattering by silver nanoparticles. Journal of the Optical Society of America. B, Optical Physics. 24: 2259-2267. PMID 19777118 DOI: 10.1364/Josab.24.002259  0.307
2007 Shuford KL, Gray SK, Ratner MA, Schatz GC. Substrate effects on surface plasmons in single nanoholes Chemical Physics Letters. 435: 123-126. DOI: 10.1016/J.Cplett.2006.12.062  0.317
2007 Gray SK. Surface plasmon-enhanced spectroscopy and photochemistry Plasmonics. 2: 143-146. DOI: 10.1007/S11468-007-9038-7  0.303
2006 Martínez R, Sierra JD, Gray SK, González M. Time dependent quantum dynamics study of the O++H2(v=0,j=0)-->OH++H ion-molecule reaction and isotopic variants (D2,HD). The Journal of Chemical Physics. 125: 164305. PMID 17092071 DOI: 10.1063/1.2359727  0.33
2006 Hankel M, Smith SC, Allan RJ, Gray SK, Balint-Kurti GG. State-to-state reactive differential cross sections for the H+H2-->H2+H reaction on five different potential energy surfaces employing a new quantum wavepacket computer code: DIFFREALWAVE. The Journal of Chemical Physics. 125: 164303. PMID 17092069 DOI: 10.1063/1.2358350  0.317
2006 Chang SH, Schatz GC, Gray SK. FDTD/TDSE study of surface-enhanced infrared absorption by metal nanoparticles Proceedings of Spie - the International Society For Optical Engineering. 6323. DOI: 10.1117/12.681514  0.335
2006 Wang X, Schatz GC, Gray SK. Ultrafast pulse excitation of a metallic nanosystem containing a Kerr nonlinear material Physical Review B - Condensed Matter and Materials Physics. 74. DOI: 10.1103/Physrevb.74.195439  0.302
2006 Oliva JM, Gray SK. A computational study of the interaction of light with silver nanowires of different eccentricity Chemical Physics Letters. 427: 383-389. DOI: 10.1016/J.Cplett.2006.06.031  0.323
2005 Chang SH, Schatz GC, Gray SK. Surface enhanced infrared absorption by nanoparticles Optics Infobase Conference Papers. DOI: 10.1364/Ls.2005.Ltua4  0.332
2005 Gray SK, Lee TW, Chang SH, Schatz GC. Electrodynamics simulations of surface plasmon behavior in metallic nanostructures Proceedings of Spie - the International Society For Optical Engineering. 5927: 1-6. DOI: 10.1117/12.614120  0.301
2005 Lee TW, Gray SK. Controlled spatiotemporal excitation of metal nanoparticles with picosecond optical pulses Physical Review B - Condensed Matter and Materials Physics. 71. DOI: 10.1103/Physrevb.71.035423  0.316
2005 Lee TW, Gray SK. Regenerated surface plasmon polaritons Applied Physics Letters. 86: 1-3. DOI: 10.1063/1.1897427  0.333
2004 Medvedev DM, Gray SK, Goldfield EM, Lakin MJ, Troya D, Schatz GC. Quantum wave packet and quasiclassical trajectory studies of OH+CO: influence of the reactant channel well on thermal rate constants. The Journal of Chemical Physics. 120: 1231-8. PMID 15268248 DOI: 10.1063/1.1632901  0.313
2004 Chang S, Gray SK, Schatz GC. 3D FDTD modeling of surface plasmons at single nanoholes in metal films Frontiers in Optics. DOI: 10.1364/Fio.2004.Fwj2  0.315
2003 Miquel I, González M, Sayós R, Balint-Kurti GG, Gray SK, Goldfield EM. Quantum reactive scattering calculations of cross sections and rate constants for the N(2D) + O2(X 3∑g -)→O(3P) + NO(X 2∏) reaction Journal of Chemical Physics. 118: 3111-3123. DOI: 10.1063/1.1530575  0.329
2003 Wurtz GA, Im JS, Gray SK, Wiederrecht GP. Optical Scattering from Isolated Metal Nanoparticles and Arrays Journal of Physical Chemistry B. 107: 14191-14198. DOI: 10.1021/Jp0357875  0.327
2003 Defazio P, Gray SK. A quantum dynamics study of D2 + OH → DOH + D on the WSLFH potential energy function Journal of Physical Chemistry A. 107: 7132-7137. DOI: 10.1021/Jp030190A  0.324
2003 Oliva JM, Gray SK. Theoretical study of dielectrically coated metallic nanowires Chemical Physics Letters. 379: 325-331. DOI: 10.1016/J.Cplett.2003.08.038  0.301
2002 Goldfield EM, Gray SK. A quantum dynamics study of H2 + OH → H2O + H employing the Wu-Schatz-Lendvay-Fang-Harding potential function and a four-atom implementation of the real wave packet method Journal of Chemical Physics. 117: 1604-1613. DOI: 10.1063/1.1487824  0.313
2001 Defazio P, Petrongolo C, Gray SK, Oliva C. Wave packet dynamics of the N(4S)+O2(X3Σg -)→NO(X2Π)+O(3P) reaction on the X2A′ potential energy surface Journal of Chemical Physics. 115: 3208-3214. DOI: 10.1063/1.1386653  0.318
2001 Piermarini V, Balint-Kurti GG, Gray SK, Gögtas F, Laganà A, Hernández ML. Wave packet calculation of cross sections, product state distributions, and branching ratios for the O(1D) + HCl reaction Journal of Physical Chemistry A. 105: 5743-5750. DOI: 10.1021/Jp004237T  0.313
2001 Gray SK, Goldfield EM. Highly excited bound and low-lying resonance states of H2O Journal of Physical Chemistry A. 105: 2634-2641. DOI: 10.1021/Jp003821Z  0.315
2001 Gray SK, Sumpter BG, Noid DW, Barnes MD. Quantum mechanical model of localized electrons on the surface of polymer nanospheres Chemical Physics Letters. 333: 308-313. DOI: 10.1016/S0009-2614(00)01377-4  0.31
2000 Skokov S, Tsuchida T, Nanbu S, Bowman JM, Gray SK. A comparative study of the quantum dynamics and rate constants of the O(3P)+HCl reaction described by two potential surfaces The Journal of Chemical Physics. 113: 227-236. DOI: 10.1063/1.481789  0.322
2000 Nanbu S, Gray SK, Kinoshita T, Aoyagi M. Theoretical study of the potential energy surfaces and bound states of HCP The Journal of Chemical Physics. 112: 5866-5876. DOI: 10.1063/1.481159  0.326
2000 Hankel M, Balint-Kurti GG, Gray SK. Quantum mechanical calculation of product state distributions for the O(1D) + H2 → OH+H reaction on the ground electronic state surface Journal of Chemical Physics. 113: 9658-9667. DOI: 10.1063/1.1319996  0.327
2000 Gray SK, Balint-Kurti GG, Schatz GC, Lin JJ, Liu X, Harich S, Yang X. Probing the effect of the H2 rotational state in O(1D)+H2→OH+H: Theoretical dynamics including nonadiabatic effects and a crossed molecular beam study The Journal of Chemical Physics. 113: 7330-7344. DOI: 10.1063/1.1313785  0.322
1999 Gray SK, Goldfield EM, Schatz GC, Balint-Kurti GG. Helicity decoupled quantum dynamics and capture model cross sections and rate constants for O(1D) + H2 → OH + H Physical Chemistry Chemical Physics. 1: 1141-1148. DOI: 10.1039/A809325C  0.327
1999 Gray SK, Petrongolo C, Drukker K, Schatz GC. Quantum Wave Packet Study of Nonadiabatic Effects in O(1D) + H2→ OH + H The Journal of Physical Chemistry A. 103: 9448-9459. DOI: 10.1021/Jp991601J  0.34
1999 Christoffel KM, Kim Y, Skokov S, Bowman JM, Gray SK. Quantum and quasiclassical reactive scattering of O(1D)+HCl using an ab initio potential Chemical Physics Letters. 315: 275-281. DOI: 10.1016/S0009-2614(99)01185-9  0.31
1998 Skokov S, Qi J, Bowman JM, Yang CY, Gray SK, Peterson KA, Mandelshtam VA. Accurate variational calculations and analysis of the HOCl vibrational energy spectrum Journal of Chemical Physics. 109: 10273-10283. DOI: 10.1063/1.477723  0.315
1997 Yang C, Gray SK. The effect of angular momentum on the unimolecular dissociation HCO→H+CO The Journal of Chemical Physics. 107: 7773-7786. DOI: 10.1063/1.475091  0.314
1997 Goldfield EM, Gray SK. Total angular momentum and decay of unimolecular resonances IVR-mediated vibrational predissociation Journal of the Chemical Society, Faraday Transactions. 93: 909-918. DOI: 10.1039/A606041B  0.312
1996 Roncero O, Gray SK. Quantum dynamics of ArI2vibrational predissociation including low total angular momenta: The role of intramolecular vibrational energy redistribution The Journal of Chemical Physics. 104: 4999-5011. DOI: 10.1063/1.471267  0.316
1995 Goldfield EM, Gray SK, Schatz GC. Quantum dynamics of a planar model for the complex forming OH+CO→H+CO2 reaction The Journal of Chemical Physics. 102: 8807-8817. DOI: 10.1063/1.468934  0.315
1995 Gray SK, Roncero O. Vibrational Predissociation and Intramolecular Vibrational Energy Redistribution: Three-Dimensional Quantum Dynamics of ArI2 The Journal of Physical Chemistry. 99: 2512-2519. DOI: 10.1021/J100009A008  0.33
1994 Gray SK, Verosky JM. Classical Hamiltonian structures in wave packet dynamics The Journal of Chemical Physics. 100: 5011-5022. DOI: 10.1063/1.467219  0.312
1993 Goldfield EM, Gray SK, Harding LB. Quantum dynamics of Renner–Teller vibronic coupling: The predissociation of HCO The Journal of Chemical Physics. 99: 5812-5827. DOI: 10.1063/1.465933  0.341
1992 Gray SK. Quantum dynamics of ArI2→Ar+I2 Chemical Physics Letters. 197: 86-91. DOI: 10.1016/0009-2614(92)86027-F  0.316
1991 Aoyagi M, Gray SK. Rotation–vibration interactions in formaldehyde: Results for low vibrational excitations The Journal of Chemical Physics. 94: 195-207. DOI: 10.1063/1.460698  0.307
1991 Gray SK, Wozny CE. Fragmentation mechanisms from three‐dimensional wave packet studies: Vibrational predissociation of NeCl2, HeCl2, NeICl, and HeICl The Journal of Chemical Physics. 94: 2817-2832. DOI: 10.1063/1.459858  0.3
1989 Gray SK, Wozny CE. Wave packet dynamics of van der Waals molecules: Fragmentation of NeCl2with three degrees of freedom The Journal of Chemical Physics. 91: 7671-7684. DOI: 10.1063/1.457236  0.311
1987 Gray SK, Rice SA. Phase space bottlenecks and statistical theories of isomerization reactions The Journal of Chemical Physics. 86: 2020-2035. DOI: 10.1063/1.452152  0.404
1986 Noid DW, Gray SK, Rice SA. Fractal behavior in classical collisional energy transfer The Journal of Chemical Physics. 84: 2649-2652. DOI: 10.1063/1.450336  0.343
1986 Gray SK, Rice SA, Noid DW. The classical mechanics of vibrational predissociation: A model based study of phase space structure and its influence on fragmentation rates The Journal of Chemical Physics. 84: 3745-3752. DOI: 10.1063/1.450215  0.441
1986 Gray SK, Rice SA. The photofragmentation of simple van der Waals complexes. Classical statistical theory and comparison with exact classical and approximate quantum dynamics results Faraday Discussions of the Chemical Society. 82: 307. DOI: 10.1039/Dc9868200307  0.448
1986 Gray SK, Rice SA, Davis MJ. Bottlenecks to unimolecular reactions and an alternative form for classical RRKM theory The Journal of Physical Chemistry. 90: 3470-3482. DOI: 10.1021/j100407a005  0.34
1985 Gray SK, Child MS, Noid DW. A uniform classical S matrix theory for bound-bound franck-condon factors Molecular Physics. 54: 573-585. DOI: 10.1080/00268978500100441  0.483
1985 Gray SK, Rice SA. A scattering resonance description of very low energy collision induced vibrational relaxation The Journal of Chemical Physics. 83: 2818-2828. DOI: 10.1063/1.449231  0.447
1984 Gray SK, Child MS. The vibrational energy states of two coupled modes in formaldehyde classical, quantum and semiclassical analysis Molecular Physics. 53: 961-989. DOI: 10.1080/00268978400102771  0.518
1984 Gray SK, Child MS. Photodissociation within classical 5 matrix theory hyperbolic umbilic uniform approximation and application to CH3i+ħω→CH3 + I+ Molecular Physics. 51: 189-210. DOI: 10.1080/00268978400100151  0.493
1984 Dardi PS, Gray SK. Classical and quantum mechanical studies of overtone and multiphoton absorption of HF in an intense laser field The Journal of Chemical Physics. 80: 4738-4747. DOI: 10.1063/1.446538  0.321
1983 Waite BA, Gray SK, Miller WH. Mode specificity in the unimolecular dissociation of formaldehyde (H2CO→H2+CO), a two‐mode model The Journal of Chemical Physics. 78: 259-265. DOI: 10.1063/1.444550  0.381
1982 Gray S, Miller W. Classical model for electronic degrees of freedom: charge transfer in Na + I collisions Chemical Physics Letters. 93: 341-344. DOI: 10.1016/0009-2614(82)83705-6  0.358
1981 Gray SK, Miller WH, Yamaguchi Y, Schaefer HF. Tunneling in the unimolecular decomposition of formaldehyde: a more quantitative study Journal of the American Chemical Society. 103: 1900-1904. DOI: 10.1021/Ja00398A004  0.323
1981 Osamura Y, Schaefer HF, Gray SK, Miller WH. Vinylidene: a very shallow minimum on the C2H2 potential energy surface Journal of the American Chemical Society. 103: 1904-1907. DOI: 10.1002/Chin.198129158  0.346
1981 GRAY SK, MILLER WH, YAMAGUCHI Y, SCHAEFER HFI. ChemInform Abstract: TUNNELING IN THE UNIMOLECULAR DECOMPOSITION OF FORMALDEHYDE: A MORE QUANTITATIVE STUDY Chemischer Informationsdienst. 12. DOI: 10.1002/chin.198129133  0.324
1980 Gray SK, Miller WH, Yamaguchi Y, Schaefer HF. Reaction path Hamiltonian: Tunneling effects in the unimolecular isomerization HNC→HCN The Journal of Chemical Physics. 73: 2733-2750. DOI: 10.1063/1.440494  0.371
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