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Scott M. Auerbach, Ph.D. - Publications

Affiliations: 
1993 Chemistry University of California, Berkeley, Berkeley, CA, United States 
 1995- Chemistry University of Massachusetts, Amherst, Amherst, MA 
Area:
Physical chemistry. Materials Science.
Website:
https://www.umass.edu/chemistry/faculty/scott-auerbach
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92 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
2020 Manookian B, Hernandez ED, Baer MD, Mundy CJ, Jentoft FC, Auerbach SM. Experimental and DFT Calculated IR Spectra of Guests in Zeolites: Acyclic Olefins and Host–Guest Interactions Journal of Physical Chemistry C. 124: 10561-10572. DOI: 10.1021/Acs.Jpcc.0C01225  0.315
2019 Wang T, Luo S, Tompsett GA, Timko MT, Fan W, Auerbach SM. The Critical Role of Tricyclic Bridges Including Neighboring Rings for Understanding Raman Spectra of Zeolites. Journal of the American Chemical Society. PMID 31778307 DOI: 10.1021/Jacs.9B10346  0.305
2019 Helfrecht BA, Semino R, Pireddu G, Auerbach SM, Ceriotti M. A new kind of atlas of zeolite building blocks. The Journal of Chemical Physics. 151: 154112. PMID 31640382 DOI: 10.1063/1.5119751  0.308
2018 Bores C, Auerbach SM, Monson PA. Modeling the Role of Excluded Volume in Zeolite Structure Direction. The Journal of Physical Chemistry Letters. PMID 29909633 DOI: 10.1021/Acs.Jpclett.8B01467  0.359
2018 Migues AN, Sun Q, Vaitheeswaran S, Sherman W, Auerbach SM. On the Rational Design of Zeolite Clusters for Converging Reaction Barriers: Quantum Study of Aldol Kinetics Confined in HZSM-5 The Journal of Physical Chemistry C. 122: 23230-23241. DOI: 10.1021/Acs.Jpcc.8B08684  0.741
2017 Bores C, Auerbach SM, Monson PA. Enhanced replica exchange reactive Monte Carlo simulations for constructing zeolite frameworks Molecular Simulation. 44: 453-462. DOI: 10.1080/08927022.2017.1399375  0.364
2017 Chien S, Pérez-Sánchez G, Gomes JRB, Cordeiro MNDS, Jorge M, Auerbach SM, Monson PA. Molecular Simulations of the Synthesis of Periodic Mesoporous Silica Phases at High Surfactant Concentrations The Journal of Physical Chemistry C. 121: 4564-4575. DOI: 10.1021/Acs.Jpcc.6B09429  0.316
2016 Sun Q, Harvey JA, Greco KV, Auerbach SM. Molecular Simulations of Hydrogen-Bond Cluster Size and Reorientation Dynamics in Liquid and Glassy Azole Systems. The Journal of Physical Chemistry. B. PMID 27632578 DOI: 10.1021/Acs.Jpcb.6B07148  0.73
2016 Shi H, Auerbach SM, Ramasubramaniam A. First-Principles Predictions of Structure-Function Relationships of Graphene-Supported Platinum Nanoclusters Journal of Physical Chemistry C. 120: 11899-11909. DOI: 10.1021/Acs.Jpcc.6B01288  0.342
2016 Pérez-Sánchez G, Chien SC, Gomes JRB, Cordeiro NDSM, Auerbach SM, Monson PA, Jorge M. Multiscale Model for the Templated Synthesis of Mesoporous Silica: The Essential Role of Silica Oligomers Chemistry of Materials. 28: 2715-2727. DOI: 10.1021/Acs.Chemmater.6B00348  0.371
2015 Chien SC, Auerbach SM, Monson PA. Modeling the self-assembly of silica-templated nanoparticles in the initial stages of zeolite formation. Langmuir : the Acs Journal of Surfaces and Colloids. 31: 4940-9. PMID 25872102 DOI: 10.1021/Acs.Langmuir.5B00382  0.728
2015 Auerbach SM, Fan W, Monson PA. Modelling the assembly of nanoporous silica materials International Reviews in Physical Chemistry. 34: 35-70. DOI: 10.1080/0144235X.2014.988038  0.32
2015 Migues AN, Muskat A, Auerbach SM, Sherman W, Vaitheeswaran S. On the rational design of zeolite clusters Acs Catalysis. 5: 2859-2865. DOI: 10.1021/Cs501827P  0.379
2015 Khan MN, Auerbach SM, Monson PA. Lattice Monte Carlo Simulations in Search of Zeolite Analogues: Effects of Structure Directing Agents Journal of Physical Chemistry C. 119: 28046-28054. DOI: 10.1021/Acs.Jpcc.5B09450  0.32
2015 Chien SC, Auerbach SM, Monson PA. Reactive Ensemble Monte Carlo Simulations of Silica Polymerization That Yield Zeolites and Related Crystalline Microporous Structures Journal of Physical Chemistry C. 119: 26628-26635. DOI: 10.1021/Acs.Jpcc.5B09404  0.408
2014 Khan MN, Auerbach SM, Monson PA. Lattice model for silica polymerization: Monte Carlo simulations of the transition between gel and nanoparticle phases. The Journal of Physical Chemistry. B. 118: 10989-99. PMID 25140440 DOI: 10.1021/Jp504961Q  0.36
2014 Harvey JA, Auerbach SM. Simulating Hydrogen-Bond Structure and Dynamics in Glassy Solids Composed of Imidazole Oligomers. The Journal of Physical Chemistry. B. PMID 24950036 DOI: 10.1021/Jp500671T  0.771
2014 Shi H, Migues AN, Auerbach SM. Ab initio and classical simulations of the temperature dependence of zeolite pore sizes Green Chemistry. 16: 875-884. DOI: 10.1039/C3Gc41681J  0.411
2014 Migues AN, Vaitheeswaran S, Auerbach SM. Density functional theory study of mixed aldol condensation catalyzed by acidic zeolites HZSM-5 and HY Journal of Physical Chemistry C. 118: 20283-20290. DOI: 10.1021/Jp504131Y  0.373
2013 Santander JE, Tsapatsis M, Auerbach SM. Simulating adsorptive expansion of zeolites: Application to biomass-derived solutions in contact with silicalite Langmuir. 29: 4866-4876. PMID 23495719 DOI: 10.1021/La300932A  0.643
2013 Jin L, Auerbach SM, Monson PA. Simulating the formation of surfactant-templated mesoporous silica materials: a model with both surfactant self-assembly and silica polymerization. Langmuir : the Acs Journal of Surfaces and Colloids. 29: 766-80. PMID 23215244 DOI: 10.1021/La304475J  0.398
2013 Vaitheeswaran S, Green SK, Dauenhauer P, Auerbach SM. On the way to biofuels from furan: Discriminating Diels-Alder and ring-opening mechanisms Acs Catalysis. 3: 2012-2019. DOI: 10.1021/Cs4003904  0.38
2012 Jin L, Auerbach SM, Monson PA. Emergence of Zeolite Analogs and other Microporous Crystals in an Atomic Lattice Model of Silica and Related Materials. The Journal of Physical Chemistry Letters. 3: 761-5. PMID 26286287 DOI: 10.1021/Jz3001097  0.37
2012 Agarwal V, Dauenhauer PJ, Huber GW, Auerbach SM. Ab initio dynamics of cellulose pyrolysis: nascent decomposition pathways at 327 and 600 °C. Journal of the American Chemical Society. 134: 14958-72. PMID 22889121 DOI: 10.1021/Ja305135U  0.735
2012 Harvey JA, Basak D, Venkataraman D, Auerbach SM. Simulating hydrogen-bond clustering and phase behaviour of imidazole oligomers Molecular Physics. 110: 957-966. DOI: 10.1080/00268976.2012.680515  0.436
2011 Agarwal V, Huber GW, Conner WC, Auerbach SM. Simulating infrared spectra and hydrogen bonding in cellulose Iβ at elevated temperatures. The Journal of Chemical Physics. 135: 134506. PMID 21992323 DOI: 10.1063/1.3646306  0.726
2011 Jobic H, Santander JE, Conner WC, Wittaker G, Giriat G, Harrison A, Ollivier J, Auerbach SM. Experimental evidence of selective heating of molecules adsorbed in nanopores under microwave radiation. Physical Review Letters. 106: 157401. PMID 21568614 DOI: 10.1103/Physrevlett.106.157401  0.622
2011 Viswanathan U, Basak D, Venkataraman D, Fermann JT, Auerbach SM. Modeling energy landscapes of proton motion in nonaqueous, tethered proton wires. The Journal of Physical Chemistry. A. 115: 5423-34. PMID 21553870 DOI: 10.1021/Jp1051535  0.356
2011 Nagamani C, Viswanathan U, Versek C, Tuominen MT, Auerbach SM, Thayumanavan S. Importance of dynamic hydrogen bonds and reorientation barriers in proton transport. Chemical Communications (Cambridge, England). 47: 6638-40. PMID 21547306 DOI: 10.1039/C1Cc11207D  0.33
2011 Jin L, Auerbach SM, Monson PA. Modeling three-dimensional network formation with an atomic lattice model: application to silicic acid polymerization. The Journal of Chemical Physics. 134: 134703. PMID 21476765 DOI: 10.1063/1.3575188  0.375
2011 Malani A, Auerbach SM, Monson PA. Monte Carlo simulations of silica polymerization and network formation Journal of Physical Chemistry C. 115: 15988-16000. DOI: 10.1021/Jp202209G  0.421
2011 Agarwal V, Conner WC, Auerbach SM. DFT study of nitrogen-substituted FAU: Effects of ion exchange and aluminum content on base strength Journal of Physical Chemistry C. 115: 188-194. DOI: 10.1021/Jp106971U  0.323
2011 Jae J, Tompsett GA, Foster AJ, Hammond KD, Auerbach SM, Lobo RF, Huber GW. Investigation into the shape selectivity of zeolite catalysts for biomass conversion Journal of Catalysis. 279: 257-268. DOI: 10.1016/J.Jcat.2011.01.019  0.319
2011 Gerardi HK, Gardenier GH, Viswanathan U, Auerbach SM, Johnson MA. Vibrational predissociation spectroscopy and theory of Ar-tagged, protonated Imidazole (Im) Im1-3H+·Ar clusters Chemical Physics Letters. 501: 172-178. DOI: 10.1016/J.Cplett.2010.10.062  0.318
2011 Shen W, Tompsett GA, Hammond KD, Xing R, Dogan F, Grey CP, Conner WC, Auerbach SM, Huber GW. Liquid phase aldol condensation reactions with MgO-ZrO2 and shape-selective nitrogen-substituted NaY Applied Catalysis a: General. 392: 57-68. DOI: 10.1016/J.Apcata.2010.10.023  0.344
2010 Malani A, Auerbach SM, Monson PA. Probing the mechanism of silica polymerization at ambient temperatures using Monte Carlo simulations Journal of Physical Chemistry Letters. 1: 3219-3224. DOI: 10.1021/Jz101046Y  0.428
2010 Jin L, Auerbach SM, Monson PA. Modeling nanoparticle formation during early stages of zeolite growth: A low-coordination lattice model of template penetration Journal of Physical Chemistry C. 114: 14393-14401. DOI: 10.1021/Jp1044207  0.314
2010 Agarwal V, Huber GW, Curtis Conner W, Auerbach SM. Kinetic stability of nitrogen-substituted sites in HY and silicalite from first principles Journal of Catalysis. 270: 249-255. DOI: 10.1016/J.Jcat.2010.01.001  0.372
2010 Agarwal V, Huber GW, Conner WC, Auerbach SM. DFT study of nitrided zeolites: Mechanism of nitrogen substitution in HY and silicalite Journal of Catalysis. 269: 53-63. DOI: 10.1016/J.Jcat.2009.10.015  0.388
2009 Dogan F, Hammond KD, Tompsett GA, Huo H, Conner WC, Auerbach SM, Grey CP. Searching for microporous, strongly basic catalysts: experimental and calculated 29Si NMR spectra of heavily nitrogen-doped Y zeolites. Journal of the American Chemical Society. 131: 11062-79. PMID 19722674 DOI: 10.1021/Ja9031133  0.364
2009 Santander JE, Conner WC, Jobic H, Auerbach SM. Simulating microwave-heated open systems: tuning competitive sorption in zeolites. The Journal of Physical Chemistry. B. 113: 13776-81. PMID 19534490 DOI: 10.1021/Jp902946G  0.635
2009 Gharibeh M, Tompsett G, Lu F, Auerbach SM, Yngvesson KS, Conner WC. Temperature distributions within zeolite precursor solutions in the presence of microwaves. The Journal of Physical Chemistry. B. 113: 12506-20. PMID 19469480 DOI: 10.1021/Jp900394U  0.304
2008 Hammond KD, Dogan F, Tompsett GA, Agarwal V, Conner WC, Grey CP, Auerbach SM. Spectroscopic signatures of nitrogen-substituted zeolites. Journal of the American Chemical Society. 130: 14912-3. PMID 18855470 DOI: 10.1021/Ja8044844  0.686
2007 Ford MH, Auerbach SM, Monson PA. Further studies of a simple atomistic model of silica: thermodynamic stability of zeolite frameworks as silica polymorphs. The Journal of Chemical Physics. 126: 144701. PMID 17444726 DOI: 10.1063/1.2712440  0.361
2007 Combariza AF, Sullivan E, Auerbach SM. Simulating non-equilibrium dynamics of molecules confined in zeolite nanopores: Effects of implicit and explicit thermostats on microwave heated fluids European Physical Journal-Special Topics. 141: 93-99. DOI: 10.1140/Epjst/E2007-00023-1  0.364
2007 Viswanathan U, Fermann JT, Toy LK, Auerbach SM, Vreven T, Frisch MJ. Modeling Proton Jumps in HY Zeolite:  Effects of Acid Site Heterogeneity The Journal of Physical Chemistry C. 111: 18341-18347. DOI: 10.1021/Jp0759675  0.388
2007 Schüring A, Auerbach SM, Fritzsche S. A simple method for sampling partition function ratios Chemical Physics Letters. 450: 164-169. DOI: 10.1016/J.Cplett.2007.11.007  0.374
2006 Jorge M, Auerbach SM, Monson PA. Modeling spontaneous formation of precursor nanoparticles in clear-solution zeolite synthesis. Journal of the American Chemical Society. 127: 14388-400. PMID 16218634 DOI: 10.1021/Ja052402I  0.303
2006 Ford MH, Auerbach SM, Monson PA. On the mechanical properties and phase behavior of silica: a simple model based on low coordination and strong association. The Journal of Chemical Physics. 121: 8415-22. PMID 15511163 DOI: 10.1063/1.1797979  0.326
2006 Jorge M, Auerbach SM, Monson PA. Modelling the thermal stability of precursor nanoparticles in zeolite synthesis Molecular Physics. 104: 3513-3522. DOI: 10.1080/00268970601014864  0.366
2006 Jobic H, Ramanan H, Auerbach SM, Tsapatsis M, Fouquet P. Probing cooperative jump-diffusion in zeolites: Neutron spin-echo measurements and molecular dynamics simulations of benzene in NaX Microporous and Mesoporous Materials. 90: 307-313. DOI: 10.1016/J.Micromeso.2005.11.006  0.351
2005 Fermann JT, Moniz T, Kiowski O, McIntire TJ, Auerbach SM, Vreven T, Frisch MJ. Modeling Proton Transfer in Zeolites:  Convergence Behavior of Embedded and Constrained Cluster Calculations. Journal of Chemical Theory and Computation. 1: 1232-9. PMID 26631667 DOI: 10.1021/Ct0501203  0.35
2005 Combariza AF, Sullivan E, Auerbach SM, Blanco C. Simulating the relaxation dynamics of microwave-driven zeolites. The Journal of Physical Chemistry. B. 109: 18439-44. PMID 16853374 DOI: 10.1021/Jp0524680  0.364
2005 Astala R, Auerbach SM, Monson PA. Normal mode approach for predicting the mechanical properties of solids from first principles: Application to compressibility and thermal expansion of zeolites Physical Review B. 71. DOI: 10.1103/Physrevb.71.014112  0.306
2005 Auerbach SM, Ford MH, Monson P. New insights into zeolite formation from molecular modeling Current Opinion in Colloid & Interface Science. 10: 220-225. DOI: 10.1016/J.Cocis.2005.09.012  0.374
2004 Astala R, Auerbach SM. The properties of methylene- and amine-substituted zeolites from first principles. Journal of the American Chemical Society. 126: 1843-8. PMID 14871117 DOI: 10.1021/Ja037890D  0.327
2004 Blanco C, Auerbach SM. Simulating Microwave-Heated Diffusion in Zeolite Nanopores Journal of Computational and Theoretical Nanoscience. 1: 180-186. DOI: 10.1166/Jctn.2004.014  0.365
2004 Astala R, Auerbach SM, Monson PA. Density Functional Theory Study of Silica Zeolite Structures:  Stabilities and Mechanical Properties of SOD, LTA, CHA, MOR, and MFI The Journal of Physical Chemistry B. 108: 9208-9215. DOI: 10.1021/Jp0493733  0.325
2004 Ramanan H, Auerbach SM, Tsapatsis M. Beyond lattice models of activated transport in zeolites: High-temperature molecular dynamics of self-diffusion and cooperative diffusion of benzene in NaX Journal of Physical Chemistry B. 108: 17171-17178. DOI: 10.1021/Jp0476242  0.375
2004 Ramanan H, Auerbach SM, Tsapatsis M. Predicting benzene fluxes in NaX membranes from atomistic simulations of cooperative diffusivities Journal of Physical Chemistry B. 108: 17179-17187. DOI: 10.1021/Jp047622H  0.383
2004 Schüring A, Auerbach SM, Fritzsche S, Haberlandt R. Random walk treatment of dumb-bell molecules in an LTA zeolite and in chabazite Studies in Surface Science and Catalysis. 154: 2110-2117. DOI: 10.1016/S0167-2991(04)80753-5  0.315
2003 Turaga SC, Auerbach SM. Calculating free energies for diffusion in tight-fitting zeolite-guest systems: Local normal-mode Monte Carlo Journal of Chemical Physics. 118: 6512-6517. DOI: 10.1063/1.1558033  0.353
2003 and CB, Auerbach SM. Nonequilibrium Molecular Dynamics of Microwave-Driven Zeolite−Guest Systems: Loading Dependence of Athermal Effects Journal of Physical Chemistry B. 107: 2490-2499. DOI: 10.1021/Jp026959L  0.34
2002 Blanco C, Auerbach SM. Microwave-driven zeolite-guest systems show athermal effects from nonequilibrium molecular dynamics. Journal of the American Chemical Society. 124: 6250-1. PMID 12033848 DOI: 10.1021/Ja017839E  0.37
2002 Schüring A, Auerbach SM, Fritzsche S, Haberlandt R. On entropic barriers for diffusion in zeolites: A molecular dynamics study Journal of Chemical Physics. 116: 10890-10894. DOI: 10.1063/1.1480011  0.389
2001 Jaramillo E, Grey CP, Auerbach SM. Molecular Dynamics Studies of Hydrofluorocarbons in Faujasite-type Zeolites:  Modeling Guest-Induced Cation Migration in Dry Zeolites The Journal of Physical Chemistry B. 105: 12319-12329. DOI: 10.1021/Jp011997A  0.322
2001 Fermann JT, Auerbach SM. Modeling Proton Mobility in Acidic Zeolite Clusters. 3. A Sudden Approximation via Semiclassical Rate Theory Journal of Physical Chemistry A. 105: 2879-2884. DOI: 10.1021/Jp003822R  0.354
2000 Auerbach SM. Theory and simulation of jump dynamics, diffusion and phase equilibrium in nanopores International Reviews in Physical Chemistry. 19: 155-198. DOI: 10.1080/01442350050020879  0.368
2000 Fermann JT, Auerbach S. Modeling proton mobility in acidic zeolite clusters. II. Room temperature tunneling effects from semiclassical rate theory Journal of Chemical Physics. 112: 6787-6794. DOI: 10.1063/1.481318  0.357
2000 Fermann JT, Blanco C, Auerbach S. Modeling proton mobility in acidic zeolite clusters. I. Convergence of transition state parameters from quantum chemistry Journal of Chemical Physics. 112: 6779-6786. DOI: 10.1063/1.481253  0.338
2000 Jousse F, Auerbach SM, Vercauteren DP. Correlation effects in molecular diffusion in zeolites at infinite dilution Journal of Chemical Physics. 112: 1531-1540. DOI: 10.1063/1.480699  0.324
2000 Blanco C, Saravanan C, Allen M, Auerbach SM. Modeling benzene orientational randomization in Na-Y zeolite at finite loadings with kinetic Monte Carlo and master equation methods Journal of Chemical Physics. 113: 9778-9787. DOI: 10.1063/1.1321056  0.353
2000 Dukovski I, Machta J, Saravanan C, Auerbach SM. Cluster Monte Carlo simulations of phase transitions and critical phenomena in zeolites Journal of Chemical Physics. 113: 3697-3703. DOI: 10.1063/1.1287655  0.378
2000 Jousse F, Auerbach SM, Jobic H, Vercauteren DP. Simulations of low-frequency vibrations of adsorbed molecules in zeolites Journal De Physique Iv. 10. DOI: 10.1051/Jp4:2000729  0.346
2000 Jousse F, Vercauteren DP, Auerbach SM. How Does Benzene in NaY Zeolite Couple to the Framework Vibrations Journal of Physical Chemistry B. 104: 8768-8778. DOI: 10.1021/Jp9942872  0.364
1999 Saravanan C, Auerbach SM. Theory and simulation of cohesive diffusion in nanopores: Transport in subcritical and supercritical regimes Journal of Chemical Physics. 110: 11000-11011. DOI: 10.1063/1.479005  0.366
1999 Jaramillo E, Auerbach SM. New Force Field for Na Cations in Faujasite-Type Zeolites Journal of Physical Chemistry B. 103: 9589-9594. DOI: 10.1021/Jp991387Z  0.364
1998 Favre DE, Schaefer DJ, Auerbach SM, Chmelka BF. Direct measurement of intercage hopping in strongly adsorbing guest-Zeolite systems Physical Review Letters. 81: 5852-5855. DOI: 10.1103/Physrevlett.81.5852  0.344
1998 Saravanan C, Jousse F, Auerbach SM. Ising Model Of Diffusion In Molecular Sieves Physical Review Letters. 80: 5754-5757. DOI: 10.1103/Physrevlett.80.5754  0.343
1998 Saravanan C, Auerbach SM. Simulations of high Tc vapor-liquid phase transitions in nanoporous materials Journal of Chemical Physics. 109: 8755-8758. DOI: 10.1063/1.477544  0.359
1998 Saravanan C, Jousse F, Auerbach SM. Modeling the concentration dependence of diffusion in zeolites. III. Testing mean field theory for benzene in Na–Y with simulation Journal of Chemical Physics. 108: 2162-2169. DOI: 10.1063/1.475595  0.376
1998 Jousse F, Auerbach SM, Vercauteren DP. Capturing the Concentration Dependence of trans-2-Butene Diffusion in Silicalite-2 Zeolite with a Jump Diffusion Model Journal of Physical Chemistry B. 102: 6507-6514. DOI: 10.1021/Jp980856E  0.364
1997 Jousse F, Auerbach SM. Activated diffusion of benzene in NaY zeolite: Rate constants from transition state theory with dynamical corrections Journal of Chemical Physics. 107: 9629-9639. DOI: 10.1063/1.475267  0.364
1997 Saravanan C, Auerbach SM. Modeling the concentration dependence of diffusion in zeolites. II. Kinetic Monte Carlo simulations of benzene in Na-Y Journal of Chemical Physics. 107: 8132-8137. DOI: 10.1063/1.475076  0.393
1997 Saravanan C, Auerbach SM. Modeling the concentration dependence of diffusion in zeolites. I. Analytical theory for benzene in Na-Y Journal of Chemical Physics. 107: 8120-8131. DOI: 10.1063/1.475075  0.336
1997 Auerbach SM. Analytical theory of benzene diffusion in Na-Y zeolite Journal of Chemical Physics. 106: 7810-7815. DOI: 10.1063/1.473738  0.338
1996 Auerbach SM, Metiu HI. Diffusion in zeolites via cage‐to‐cage kinetics: Modeling benzene diffusion in Na‐Y The Journal of Chemical Physics. 105: 3753-3760. DOI: 10.1063/1.472195  0.548
1996 Auerbach SM, Bull LM, Henson NJ, Metiu HI, Cheetham AK. Behavior of Benzene in Na-X and Na-Y Zeolites:  Comparative Study by2H NMR and Molecular Mechanics The Journal of Physical Chemistry. 100: 5923-5930. DOI: 10.1021/Jp953260P  0.514
1995 Auerbach SM, Henson NJ, Cheetham AK, Metiu HI. Transport Theory for Cationic Zeolites: Diffusion of Benzene in Na-Y The Journal of Physical Chemistry. 99: 10600-10608. DOI: 10.1021/J100026A025  0.559
1994 Auerbach SM, Miller WH. Efficient polynomial expansion of the scattering Green’s function: Application to the D+H2(v=1) rate constant The Journal of Chemical Physics. 100: 1103-1112. DOI: 10.1063/1.466642  0.477
1993 Auerbach SM, Miller WH. Quantum mechanical reaction probabilities with a power series Green’s function The Journal of Chemical Physics. 98: 6917-6928. DOI: 10.1063/1.464759  0.467
1990 Auerbach SM, Zhang JZH, Miller WH. Comparison of quantum scattering calculations for the H + H2 reaction using the LSTH and DMBE potentials Journal of the Chemical Society, Faraday Transactions. 86: 1701. DOI: 10.1039/Ft9908601701  0.383
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