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Ward H. Thompson - Publications

Affiliations: 
Chemistry University of Kansas, Lawrence, KS, United States 
Area:
Physical Chemistry
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100 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
2023 Piskulich ZA, Laage D, Thompson WH. A structure-dynamics relationship enables prediction of the water hydrogen bond exchange activation energy from experimental data. Chemical Science. 15: 2197-2204. PMID 38332825 DOI: 10.1039/d3sc04495e  0.414
2023 Rick SW, Thompson WH. Effects of polarizability and charge transfer on water dynamics and the underlying activation energies. The Journal of Chemical Physics. 158. PMID 37191215 DOI: 10.1063/5.0151253  0.379
2023 Piskulich ZA, Borkowski AK, Thompson WH. A Maxwell relation for dynamical timescales with application to the pressure and temperature dependence of water self-diffusion and shear viscosity. Physical Chemistry Chemical Physics : Pccp. PMID 37129891 DOI: 10.1039/d3cp01386c  0.774
2022 Gomez A, Piskulich ZA, Thompson WH, Laage D. Water Diffusion Proceeds via a Hydrogen-Bond Jump Exchange Mechanism. The Journal of Physical Chemistry Letters. 13: 4660-4666. PMID 35604934 DOI: 10.1021/acs.jpclett.2c00825  0.827
2021 Piskulich ZA, Laage D, Thompson WH. Using Activation Energies to Elucidate Mechanisms of Water Dynamics. The Journal of Physical Chemistry. A. PMID 34748353 DOI: 10.1021/acs.jpca.1c08020  0.829
2021 Roget SA, Piskulich ZA, Thompson WH, Fayer MD. Identical Water Dynamics in Acrylamide Hydrogels, Polymers, and Monomers in Solution: Ultrafast IR Spectroscopy and Molecular Dynamics Simulations. Journal of the American Chemical Society. PMID 34491037 DOI: 10.1021/jacs.1c07151  0.795
2021 Piskulich ZA, Thompson WH. Examining the Role of Different Molecular Interactions on Activation Energies and Activation Volumes in Liquid Water. Journal of Chemical Theory and Computation. PMID 33819026 DOI: 10.1021/acs.jctc.0c01217  0.81
2021 Senanayake HS, Greathouse JA, Ilgen AG, Thompson WH. Simulations of the IR and Raman spectra of water confined in amorphous silica slit pores. The Journal of Chemical Physics. 154: 104503. PMID 33722003 DOI: 10.1063/5.0040739  0.341
2021 Piskulich ZA, Laage D, Thompson WH. On the role of hydrogen-bond exchanges in the spectral diffusion of water. The Journal of Chemical Physics. 154: 064501. PMID 33588543 DOI: 10.1063/5.0041270  0.819
2020 Borkowski AK, Piskulich ZA, Thompson WH. Examining the Hofmeister Series through Activation Energies: Water Diffusion in Aqueous Alkali-Halide Solutions. The Journal of Physical Chemistry. B. PMID 33382267 DOI: 10.1021/acs.jpcb.0c09965  0.791
2020 Piskulich ZA, Thompson WH. Temperature Dependence of the Water Infrared Spectrum: Driving Forces, Isosbestic Points, and Predictions. The Journal of Physical Chemistry Letters. 7762-7768. PMID 32852956 DOI: 10.1021/Acs.Jpclett.0C02301  0.755
2020 Piskulich ZA, Laage D, Thompson WH. Activation energies and the extended jump model: How temperature affects reorientation and hydrogen-bond exchange dynamics in water. The Journal of Chemical Physics. 153: 074110. PMID 32828097 DOI: 10.1063/5.0020015  0.83
2020 Yamada SA, Hung ST, Thompson WH, Fayer MD. Effects of pore size on water dynamics in mesoporous silica. The Journal of Chemical Physics. 152: 154704. PMID 32321257 DOI: 10.1063/1.5145326  0.494
2020 Katiyar A, Freire Sovierzoski JC, Calio PB, Vartia AA, Thompson WH. Water plays a dynamical role in a hydrogen-bonded, hexameric supramolecular assembly. Physical Chemistry Chemical Physics : Pccp. PMID 32124881 DOI: 10.1039/C9Cp06874K  0.804
2020 Piskulich ZA, Thompson WH. The dynamics of supercooled water can be predicted from room temperature simulations. The Journal of Chemical Physics. 152: 074505. PMID 32087653 DOI: 10.1063/1.5139435  0.8
2020 Piskulich ZA, Thompson WH. On the temperature dependence of liquid structure. The Journal of Chemical Physics. 152: 011102. PMID 31914747 DOI: 10.1063/1.5135932  0.768
2019 Piskulich ZA, Mesele OO, Thompson WH. Activation Energies and Beyond. The Journal of Physical Chemistry. A. PMID 31250645 DOI: 10.1021/Acs.Jpca.9B03967  0.781
2019 Mendis CH, Piskulich ZA, Thompson WH. Tests of the Stokes-Einstein Relation through the Shear Viscosity Activation Energy of Water. The Journal of Physical Chemistry. B. PMID 31194553 DOI: 10.1021/Acs.Jpcb.9B04647  0.792
2019 Katiyar A, Freire Sovierzoski JC, Calio PB, Vartia AA, Thompson WH. Water plays a diverse role in a hydrogen-bonded, hexameric supramolecular assembly. Chemical Communications (Cambridge, England). PMID 31116200 DOI: 10.1039/C9Cc03151K  0.812
2019 Palafox-Hernandez JP, Mendis CH, Thompson WH, Laird BB. Pressure and Temperature Tuning of Gas-Expanded Liquid Structure and Dynamics. The Journal of Physical Chemistry. B. PMID 30848599 DOI: 10.1021/Acs.Jpcb.8B09826  0.631
2019 Yamada SA, Shin JY, Thompson WH, Fayer MD. Water Dynamics in Nanoporous Silica: Ultrafast Vibrational Spectroscopy and Molecular Dynamics Simulations The Journal of Physical Chemistry C. 123: 5790-5803. DOI: 10.1021/Acs.Jpcc.9B00593  0.482
2018 Thompson WH. Perspective: Dynamics of confined liquids. The Journal of Chemical Physics. 149: 170901. PMID 30408973 DOI: 10.1063/1.5057759  0.346
2018 Piskulich ZA, Thompson WH. The activation energy for water reorientation differs between IR pump-probe and NMR measurements. The Journal of Chemical Physics. 149: 164504. PMID 30384705 DOI: 10.1063/1.5050203  0.793
2018 Piskulich ZA, Mesele OO, Thompson WH. Expanding the calculation of activation volumes: Self-diffusion in liquid water. The Journal of Chemical Physics. 148: 134105. PMID 29626912 DOI: 10.1063/1.5023420  0.788
2017 Piskulich ZA, Mesele OO, Thompson WH. Removing the barrier to the calculation of activation energies: Diffusion coefficients and reorientation times in liquid water. The Journal of Chemical Physics. 147: 134103. PMID 28987106 DOI: 10.1063/1.4997723  0.8
2017 Mesele OO, Thompson WH. A "Universal" Spectroscopic Map for the OH Stretching Mode in Alcohols. The Journal of Physical Chemistry. A. PMID 28715218 DOI: 10.1021/Acs.Jpca.7B05836  0.774
2017 Yamada SA, Thompson WH, Fayer MD. Water-anion hydrogen bonding dynamics: Ultrafast IR experiments and simulations. The Journal of Chemical Physics. 146: 234501. PMID 28641416 DOI: 10.1063/1.4984766  0.496
2016 Mesele OO, Thompson WH. Removing the barrier to the calculation of activation energies. The Journal of Chemical Physics. 145: 134107. PMID 27782445 DOI: 10.1063/1.4964284  0.796
2016 Abel S, Galamba N, Karakas E, Marchi M, Thompson WH, Laage D. On the Structural and Dynamical Properties of DOPC Reverse Micelles. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 27649391 DOI: 10.1021/Acs.Langmuir.6B02566  0.679
2016 Burris PC, Laage D, Thompson WH. Simulations of the infrared, Raman, and 2D-IR photon echo spectra of water in nanoscale silica pores. The Journal of Chemical Physics. 144: 194709. PMID 27208967 DOI: 10.1063/1.4949766  0.694
2016 Joutsuka T, Thompson WH, Laage D. Vibrational Quantum Decoherence in Liquid Water. The Journal of Physical Chemistry Letters. 7: 616-21. PMID 26807717 DOI: 10.1021/Acs.Jpclett.5B02637  0.654
2016 Steenbergen KG, Kern JL, Wang Z, Thompson WH, Laird BB. Tunability of Gas-Expanded Liquids under Confinement: Phase Equilibrium and Transport Properties of Ethylene-Expanded Methanol in Mesoporous Silica The Journal of Physical Chemistry C. 120: 5010-5019. DOI: 10.1021/Acs.Jpcc.5B12750  0.617
2016 Patel PD, Laird BB, Thompson WH. A density functional theory study of ethylene epoxidation catalyzed by niobium-doped silica Journal of Molecular Catalysis a: Chemical. 424: 1-7. DOI: 10.1016/J.Molcata.2016.07.052  0.57
2016 Yan W, Ramanathan A, Patel PD, Maiti SK, Laird BB, Thompson WH, Subramaniam B. Mechanistic insights for enhancing activity and stability of Nb-incorporated silicates for selective ethylene epoxidation Journal of Catalysis. 336: 75-84. DOI: 10.1016/J.Jcat.2015.12.022  0.539
2016 Kern JL, Flynn TJ, Wang Z, Thompson WH, Laird BB. Molecular simulation of ethylene-expanded methanol: Phase behavior, structure, and transport properties Fluid Phase Equilibria. 411: 81-87. DOI: 10.1016/J.Fluid.2015.12.022  0.598
2015 Wells RH, Thompson WH. What Determines the Location of a Small Solute in a Nanoconfined Liquid? The Journal of Physical Chemistry. B. 119: 12446-54. PMID 26372781 DOI: 10.1021/Acs.Jpcb.5B04770  0.436
2015 Mesele OO, Vartia AA, Laage D, Thompson WH. Reorientation of Isomeric Butanols: The Multiple Effects of Steric Bulk Arrangement on Hydrogen-Bond Dynamics. The Journal of Physical Chemistry. B. PMID 26356232 DOI: 10.1021/Acs.Jpcb.5B07692  0.776
2015 Harvey JA, Thompson WH. Solute location in a nanoconfined liquid depends on charge distribution. The Journal of Chemical Physics. 143: 044701. PMID 26233151 DOI: 10.1063/1.4926936  0.365
2015 Liu F, Fang Y, Kumar M, Thompson WH, Lester MI. Direct observation of vinyl hydroperoxide. Physical Chemistry Chemical Physics : Pccp. 17: 20490-4. PMID 26199999 DOI: 10.1039/C5Cp02917A  0.337
2015 Harvey JA, Thompson WH. Thermodynamic Driving Forces for Dye Molecule Position and Orientation in Nanoconfined Solvents. The Journal of Physical Chemistry. B. 119: 9150-9. PMID 25295835 DOI: 10.1021/Jp509051N  0.423
2015 Thompson WH. Structure, dynamics and hydrogen bonding of acetonitrile in nanoscale silica pores Molecular Simulation. 41: 788-794. DOI: 10.1080/08927022.2014.926550  0.43
2014 Fogarty AC, Duboué-Dijon E, Laage D, Thompson WH. Origins of the non-exponential reorientation dynamics of nanoconfined water. The Journal of Chemical Physics. 141: 18C523. PMID 25399188 DOI: 10.1063/1.4896983  0.721
2014 Kumar M, Busch DH, Subramaniam B, Thompson WH. Role of tunable acid catalysis in decomposition of α-hydroxyalkyl hydroperoxides and mechanistic implications for tropospheric chemistry. The Journal of Physical Chemistry. A. 118: 9701-11. PMID 25234427 DOI: 10.1021/Jp505100X  0.369
2014 Kumar M, Busch DH, Subramaniam B, Thompson WH. Organic acids tunably catalyze carbonic acid decomposition. The Journal of Physical Chemistry. A. 118: 5020-8. PMID 24933150 DOI: 10.1021/Jp5037469  0.327
2014 Norton CD, Thompson WH. Reorientation dynamics of nanoconfined acetonitrile: a critical examination of two-state models. The Journal of Physical Chemistry. B. 118: 8227-35. PMID 24689814 DOI: 10.1021/Jp501363Q  0.384
2013 Norton CD, Thompson WH. On the diffusion of acetonitrile in nanoscale amorphous silica pores. understanding anisotropy and the effects of hydrogen bonding Journal of Physical Chemistry C. 117: 19107-19114. DOI: 10.1021/Jp407830F  0.415
2012 Vartia AA, Thompson WH. Solvation and spectra of a charge transfer solute in ethanol confined within nanoscale silica pores. The Journal of Physical Chemistry. B. 116: 5414-24. PMID 22482696 DOI: 10.1021/Jp210737C  0.775
2012 Laage D, Thompson WH. Reorientation dynamics of nanoconfined water: power-law decay, hydrogen-bond jumps, and test of a two-state model. The Journal of Chemical Physics. 136: 044513. PMID 22299897 DOI: 10.1063/1.3679404  0.715
2012 Ka BJ, Thompson WH. Sampling the proton transfer reaction coordinate in mixed quantum-classical molecular dynamics simulations. The Journal of Physical Chemistry. A. 116: 832-8. PMID 22148746 DOI: 10.1021/Jp206772E  0.349
2011 Vartia AA, Mitchell-Koch KR, Stirnemann G, Laage D, Thompson WH. On the reorientation and hydrogen-bond dynamics of alcohols. The Journal of Physical Chemistry. B. 115: 12173-8. PMID 21916487 DOI: 10.1021/Jp206875K  0.78
2011 Laird BB, Thompson WH. Time-dependent fluorescence in nanoconfined solvents: linear-response approximations and Gaussian statistics. The Journal of Chemical Physics. 135: 084511. PMID 21895203 DOI: 10.1063/1.3626825  0.63
2011 Morales CM, Thompson WH. Molecular-level mechanisms of vibrational frequency shifts in a polar liquid. The Journal of Physical Chemistry. B. 115: 7597-605. PMID 21608988 DOI: 10.1021/Jp201591C  0.345
2011 Thompson WH. Solvation dynamics and proton transfer in nanoconfined liquids. Annual Review of Physical Chemistry. 62: 599-619. PMID 21219146 DOI: 10.1146/Annurev-Physchem-032210-103330  0.384
2010 Ka BJ, Thompson WH. Nonadiabatic effects on proton transfer rate constants in a nanoconfined solvent. The Journal of Physical Chemistry. B. 114: 7535-42. PMID 20469941 DOI: 10.1021/Jp911740C  0.308
2010 Feng X, Thompson WH. Time-dependent fluorescence in nanoconfined solvents. A Smoluchowski equation model study Journal of Physical Chemistry C. 114: 4279-4290. DOI: 10.1021/Jp909617E  0.392
2009 Gulmen TS, Thompson WH. Grand canonical Monte Carlo simulations of acetonitrile filling of silica pores of varying hydrophilicity/hydrophobicity. Langmuir : the Acs Journal of Surfaces and Colloids. 25: 1103-11. PMID 19113811 DOI: 10.1021/La801896G  0.336
2009 Morales CM, Thompson WH. Simulations of infrared spectra of nanoconfined liquids: acetonitrile confined in nanoscale, hydrophilic silica pores. The Journal of Physical Chemistry. A. 113: 1922-33. PMID 19061371 DOI: 10.1021/Jp8072969  0.457
2008 Pitt MA, Zakharov LN, Vanka K, Thompson WH, Laird BB, Johnson DW. Multiple weak supramolecular interactions stabilize a surprisingly twisted As2L3 assembly. Chemical Communications (Cambridge, England). 3936-8. PMID 18726040 DOI: 10.1039/B806958A  0.559
2008 Mitchell-Koch KR, Thompson WH. Infrared spectra of a model phenol-amine proton transfer complex in nanoconfined CH3Cl. The Journal of Physical Chemistry. B. 112: 7448-59. PMID 18517239 DOI: 10.1021/Jp076714E  0.739
2008 Toriyama M, Maher TR, Holovics TC, Vanka K, Day VW, Berrie CL, Thompson WH, Barybin MV. Multipoint anchoring of the [2.2.2.2]metacyclophane motif to a gold surface via self-assembly: coordination chemistry of a cyclic tetraisocyanide revisited. Inorganic Chemistry. 47: 3284-91. PMID 18345627 DOI: 10.1021/Ic702401B  0.316
2008 Morales CM, Thompson WH. Umbrella sampling of solute vibrational line shifts in mixed quantum-classical molecular dynamics simulations. The Journal of Physical Chemistry. B. 112: 313-20. PMID 18081335 DOI: 10.1021/Jp075038D  0.335
2007 Morales CM, Thompson WH. Mixed quantum-classical molecular dynamics analysis of the molecular-level mechanisms of vibrational frequency shifts. The Journal of Physical Chemistry. A. 111: 5422-33. PMID 17580980 DOI: 10.1021/Jp071656I  0.363
2007 Laird BB, Thompson WH. On the connection between Gaussian statistics and excited-state linear response for time-dependent fluorescence. The Journal of Chemical Physics. 126: 211104. PMID 17567183 DOI: 10.1063/1.2747237  0.571
2007 Feng X, Thompson WH. Smoluchowski equation description of solute diffusion dynamics and time-dependent fluorescence in nanoconfined solvents Journal of Physical Chemistry C. 111: 18060-18072. DOI: 10.1021/Jp074516H  0.405
2007 Mitchell-Koch KR, Thompson WH. How important is entropy in determining the position-dependent free energy of a solute in a nanoconfined solvent? Journal of Physical Chemistry C. 111: 11991-12001. DOI: 10.1021/Jp072580T  0.388
2006 Gulmen TS, Thompson WH. Testing a two-state model of nanoconfined liquids: conformational equilibrium of ethylene glycol in amorphous silica pores. Langmuir : the Acs Journal of Surfaces and Colloids. 22: 10919-23. PMID 17154565 DOI: 10.1021/La062285K  0.386
2005 Li S, Thompson WH. Proton transfer in nanoconfined polar solvents. 1. Free energies and solute position. The Journal of Physical Chemistry. B. 109: 4941-6. PMID 16863151 DOI: 10.1021/Jp045036I  0.364
2005 Thompson WH. Proton transfer in nanoconfined polar solvents. II. Adiabatic proton transfer dynamics. The Journal of Physical Chemistry. B. 109: 18201-8. PMID 16853338 DOI: 10.1021/Jp053043G  0.393
2005 Gomez JA, Tucker AK, Shepherd TD, Thompson WH. Conformational free energies of 1,2-dichloroethane in nanoconfined methanol. The Journal of Physical Chemistry. B. 109: 17479-87. PMID 16853235 DOI: 10.1021/Jp052148G  0.351
2005 Gulmen TS, Thompson WH. Model silica pores with controllable surface chemistry for molecular dynamics simulations Materials Research Society Symposium Proceedings. 899: 77-86. DOI: 10.1557/Proc-0899-N06-05  0.361
2005 Li S, Thompson WH. How accurate is time-independent perturbation theory for calculating frequency shifts of diatomic molecules in rare gas fluids? Chemical Physics Letters. 405: 304-309. DOI: 10.1016/J.Cplett.2005.02.009  0.332
2004 Thompson WH. Simulations of time-dependent fluorescence in nano-confined solvents. The Journal of Chemical Physics. 120: 8125-33. PMID 15267732 DOI: 10.1063/1.1691391  0.344
2004 MacBeth CE, Gupta R, Mitchell-Koch KR, Young VG, Lushington GH, Thompson WH, Hendrich MP, Borovik AS. Utilization of hydrogen bonds to stabilize M-O(H) units: synthesis and properties of monomeric iron and manganese complexes with terminal oxo and hydroxo ligands. Journal of the American Chemical Society. 126: 2556-67. PMID 14982465 DOI: 10.1021/Ja0305151  0.709
2004 Gomez JA, Thompson WH. Monte Carlo simulations of absorption and fluorescence spectra in ellipsoidal nanocavities Journal of Physical Chemistry B. 108: 20144-20154. DOI: 10.1021/Jp049092V  0.332
2004 Li S, Shepherd TD, Thompson WH. Simulations of the vibrational relaxation of a model diatomic molecule in a nanoconfined polar solvent Journal of Physical Chemistry A. 108: 7347-7355. DOI: 10.1021/Jp048361E  0.415
2004 Li S, Thompson WH. Molecular dynamics simulations of the vibrational relaxation of I 2 in Xe on an ab initio-based potential function Chemical Physics Letters. 383: 326-331. DOI: 10.1016/J.Cplett.2003.11.041  0.379
2003 Thompson WH. A general method for implementing vibrationally adiabatic mixed quantum-classical simulations Journal of Chemical Physics. 118: 1059-1067. DOI: 10.1063/1.1528891  0.326
2003 Li S, Thompson WH. Simulations of the vibrational relaxation of I2 in Xe Journal of Physical Chemistry A. 107: 8696-8704. DOI: 10.1021/Jp0345452  0.38
2003 Laage D, Thompson WH, Blanchard-Desce M, Hynes JT. Charged push - Pull polyenes in solution: Anomalous solvatochromism and nonlinear optical properties Journal of Physical Chemistry A. 107: 6032-6046. DOI: 10.1021/Jp0276597  0.656
2002 Thompson WH. A Monte Carlo study of spectroscopy in nanoconfined solvents Journal of Chemical Physics. 117: 6618-6628. DOI: 10.1063/1.1505436  0.334
2001 Thompson WH, Hynes JT. Model study of the acid-base proton-transfer reaction of the ClH⋯OH2 pair in low-polarity solvents Journal of Physical Chemistry A. 105: 2582-2590. DOI: 10.1021/Jp003880C  0.493
2001 Bianco R, Thompson WH, Morita A, Hynes JT. Is the H2OCl+Ion a Viable Intermediate for the Hydrolysis of ClONO2on Ice Surfaces? Journal of Physical Chemistry A. 105: 3132-3139. DOI: 10.1021/Jp002599V  0.517
2001 Thompson WH. Mixed quantum-classical simulation of vibrational frequency modulations of a diatomic molecule in a rare gas fluid Chemical Physics Letters. 350: 113-118. DOI: 10.1016/S0009-2614(01)01262-3  0.316
2001 Bianco R, Thompson WH, Morita A, Hynes JT. Is the H 2OCl + Ion a Viable Intermediate for the Hydrolysis of ClONO 2 on Ice Surfaces? Journal of Physical Chemistry A. 105: 3132-3139.  0.379
2001 Thompson WH, Hynes JT. Model study of the acid-base proton-transfer reaction of the CIH⋯OH2 pair in low-polarity solvents Journal of Physical Chemistry A. 105: 2581-2590.  0.431
2000 Plaza P, Laage D, Martin MM, Alain V, Blanchard-Desce M, Thompson WH, Hynes JT. Excited-state dynamics in polar solvents of push - Pull polyenes designed for nonlinear optics Journal of Physical Chemistry A. 104: 2396-2401. DOI: 10.1021/Jp992282Z  0.698
2000 Thompson WH, Hynes JT. Frequency shifts in the hydrogen-bonded OH stretch in halide - water clusters. The importance of charge transfer Journal of the American Chemical Society. 122: 6278-6286. DOI: 10.1021/Ja993058Q  0.505
1999 Thompson WH. On Obtaining Reactive Potential Energy Surfaces from Transition State Photodetachment Spectra. II. Inversion of Spectra in Model Systems Journal of Physical Chemistry A. 103: 9506-9511. DOI: 10.1021/Jp992022H  0.32
1999 Thompson WH. On Obtaining Reactive Potential Energy Surfaces from Transition State Photodetachment Spectra. I. Sensitivity Analysis Journal of Physical Chemistry A. 103: 9500-9505. DOI: 10.1021/Jp992021P  0.316
1999 Thompson WH, Blanchard-Desce M, Alain V, Muller J, Fort A, Barzoukas M, Hynes JT. Two valence bond state model for molecular nonlinear optical properties. Comparison with push-pull polyene solution measurements Journal of Physical Chemistry A. 103: 3766-3771. DOI: 10.1021/Jp984500E  0.57
1998 Thompson WH, Blanchard-Desce M, Hynes JT. Two valence bond state model for molecular nonlinear optical properties. Nonequilibrium solvation formulation Journal of Physical Chemistry A. 102: 7712-7722. DOI: 10.1021/Jp981916J  0.579
1998 Wang H, Thompson WH, Miller WH. “Direct” Calculation of Thermal Rate Constants for the F + H2 → HF + F Reaction Journal of Physical Chemistry A. 102: 9372-9379. DOI: 10.1021/Jp981461Y  0.454
1998 Wang H, Thompson WH, Miller WH. "Direct" calculation of thermal rate constants for the F + H2 → HF + F reaction Journal of Physical Chemistry A. 102: 9372-9379.  0.33
1997 Wang H, Thompson WH, Miller WH. Thermal rate constant calculation using flux–flux autocorrelation functions: Application to Cl+H2→HCl+H reaction The Journal of Chemical Physics. 107: 7194-7201. DOI: 10.1063/1.474959  0.455
1997 Thompson WH, Miller WH. Erratum: “On the ‘direct’ calculation of thermal rate constants. II. The flux-flux autocorrelation function with absorbing potentials, with application to the O+HCl→OH+Cl reaction” [J. Chem. Phys. 106, 142 (1997)] The Journal of Chemical Physics. 107: 2164-2165. DOI: 10.1063/1.474568  0.436
1997 Thompson WH, Miller WH. On the "direct" calculation of thermal rate constants. II. The flux-flux autocorrelation function with absorbing potentials, with application to the O+HCl→OH+Cl reaction Journal of Chemical Physics. 106: 142-150. DOI: 10.1063/1.474109  0.471
1996 Thompson WH, Karlsson HO, Miller WH. Theoretical calculation of photodetachment intensities for H3O− The Journal of Chemical Physics. 105: 5387-5396. DOI: 10.1063/1.472380  0.489
1995 Thompson WH, Miller WH. On the ‘‘direct’’ calculation of thermal rate constants The Journal of Chemical Physics. 102: 7409-7417. DOI: 10.1063/1.469053  0.456
1994 Thompson WH, Miller WH. Initial state‐selected reaction probabilities for OH+H2→H+H2O and photodetachment intensities for HOH−2 The Journal of Chemical Physics. 101: 8620-8627. DOI: 10.1063/1.468057  0.491
1993 Thompson WH, Miller WH. State-specific reaction probabilities from a DVR-ABC Green function Chemical Physics Letters. 206: 123-129. DOI: 10.1016/0009-2614(93)85528-V  0.435
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