Rachel B Getman

TitleAssistant Professor
InstitutionClemson University
DepartmentDepartment of Chemical and Biomolecular Engineering
Address125 Earle Hall
Clemson, South Carolina 29634
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    Publications listed below are automatically derived from MEDLINE/PubMed and other sources, which might result in incorrect or missing publications. Faculty can login to make corrections and additions.
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    PMC Citations indicate the number of times the publication was cited by articles in PubMed Central, and the Altmetric score represents citations in news articles and social media. (Note that publications are often cited in additional ways that are not shown here.) Fields are based on how the National Library of Medicine (NLM) classifies the publication's journal and might not represent the specific topic of the publication. Translation tags are based on the publication type and the MeSH terms NLM assigns to the publication. Some publications (especially newer ones and publications not in PubMed) might not yet be assigned Field or Translation tags.) Click a Field or Translation tag to filter the publications.
    1. Duan J, Shabbir H, Chen Z, Bi W, Liu Q, Sui J, ?ordevic L, Stupp SI, Chapman KW, Martinson ABF, Li A, Schaller RD, Goswami S, Getman RB, Hupp JT. Synthetic Access to a Framework-Stabilized and Fully Sulfided Analogue of an Anderson Polyoxometalate that is Catalytically Competent for Reduction Reactions. J Am Chem Soc. 2023 Mar 22. PMID: 36947559.
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    2. Vicchio SP, Chen Z, Chapman KW, Getman RB. Computational and Experimental Characterization of the Ligand Environment of a Ni-Oxo Catalyst Supported in the Metal-Organic Framework NU-1000. J Am Chem Soc. 2023 Feb 08; 145(5):2852-2859. PMID: 36693214.
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    3. Garcia Carcamo RA, Zhang X, Estejab A, Zhou J, Hare BJ, Sievers C, Sarupria S, Getman RB. Differences in solvation thermodynamics of oxygenates at Pt/Al2O3 perimeter versus Pt(111) terrace sites. iScience. 2023 Feb 17; 26(2):105980. PMID: 36756373; PMCID: PMC9900392.
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    4. Yan Z, Chaluvadi A, FitzGerald S, Spence S, Bleyer C, Zhu J, Crawford TM, Getman RB, Watt J, Huber DL, Mefford OT. Effect of manganese substitution of ferrite nanoparticles on particle grain structure. Nanoscale Adv. 2022 Sep 13; 4(18):3957-3965. PMID: 36133337; PMCID: PMC9470023.
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    5. Estejab A, García Cárcamo RA, Getman RB, Estejab A, Garc?a C?rcamo RA, Getman RB. Influence of an electrified interface on the entropy and energy of solvation of methanol oxidation intermediates on platinum(111) under explicit solvation. Phys Chem Chem Phys. 2022 Feb 16; 24(7):4251-4261. PMID: 35107094.
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    6. Yeh B, Vicchio SP, Chheda S, Zheng J, Schmid J, Löbbert L, Bermejo-Deval R, Gutiérrez OY, Lercher JA, Lu CC, Neurock M, Getman RB, Gagliardi L, Bhan A, Yeh B, Vicchio SP, Chheda S, Zheng J, Schmid J, L?bbert L, Bermejo-Deval R, Guti?rrez OY, Lercher JA, Lu CC, Neurock M, Getman RB, Gagliardi L, Bhan A. Site Densities, Rates, and Mechanism of Stable Ni/UiO-66 Ethylene Oligomerization Catalysts. J Am Chem Soc. 2021 Dec 08; 143(48):20274-20280. PMID: 34817993.
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    7. Zhang X, Savara A, Getman RB, Zhang X, Savara A, Getman RB. A Method for Obtaining Liquid-Solid Adsorption Rates from Molecular Dynamics Simulations: Applied to Methanol on Pt(111) in H2O. J Chem Theory Comput. 2020 Apr 14; 16(4):2680-2691. PMID: 32134649.
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    8. Bodenschatz CJ, Xie T, Zhang X, Getman RB, Bodenschatz CJ, Xie T, Zhang X, Getman RB. Insights into how the aqueous environment influences the kinetics and mechanisms of heterogeneously-catalyzed COH* and CH3OH* dehydrogenation reactions on Pt(111). Phys Chem Chem Phys. 2019 May 15; 21(19):9895-9904. PMID: 31038522.
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    9. Bodenschatz CJ, Zhang X, Xie T, Arvay J, Sarupria S, Getman RB, Bodenschatz CJ, Zhang X, Xie T, Arvay J, Sarupria S, Getman RB. Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics. J Vis Exp. 2019 04 12; (146). PMID: 31033957.
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    10. Zhang X, DeFever RS, Sarupria S, Getman RB, Zhang X, DeFever RS, Sarupria S, Getman RB. Free Energies of Catalytic Species Adsorbed to Pt(111) Surfaces under Liquid Solvent Calculated Using Classical and Quantum Approaches. J Chem Inf Model. 2019 05 28; 59(5):2190-2198. PMID: 30821458.
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    11. Orr RK, Hoehn JL, Col NF, Kim IS, Li Z, Zheng J, Platero-Prats AE, Mavrandonakis A, Pellizzeri S, Ferrandon M, Vjunov A, Gallington LC, Webber TE, Vermeulen NA, Penn RL, Getman RB, Cramer CJ, Chapman KW, Camaioni DM, Fulton JL, Lercher JA, Farha OK, Hupp JT, Martinson ABF. Sinter-Resistant Platinum Catalyst Supported by Metal-Organic Framework. Angew Chem Int Ed Engl. 2018 01 22; 57(4):909-913. PMID: 29205697.
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    12. Orr RK, Hoehn JL, Col NF, Liao P, Getman RB, Snurr RQ. Optimizing Open Iron Sites in Metal-Organic Frameworks for Ethane Oxidation: A First-Principles Study. ACS Appl Mater Interfaces. 2017 Oct 04; 9(39):33484-33492. PMID: 28394564.
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    13. Dix ST, Scott JK, Getman RB, Campbell CT, Dix ST, Scott JK, Getman RB, Campbell CT. Using degrees of rate control to improve selective n-butane oxidation over model MOF-encapsulated catalysts: sterically-constrained Ag3Pd(111). Faraday Discuss. 2016 07 04; 188:21-38. PMID: 27271786.
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    14. Gomez-Gualdron DA, Dix ST, Getman RB, Snurr RQ, Gomez-Gualdron DA, Dix ST, Getman RB, Snurr RQ. A modelling approach for MOF-encapsulated metal catalysts and application to n-butane oxidation. Phys Chem Chem Phys. 2015 Nov 07; 17(41):27596-608. PMID: 26426485.
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    15. Getman RB, Getman RB. Molecular simulations: Force fields for carbon capture. Nat Chem. 2012 Oct; 4(10):777-8. PMID: 23000988.
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    16. Yuan D, Getman RB, Wei Z, Snurr RQ, Zhou HC, Yuan D, Getman RB, Wei Z, Snurr RQ, Zhou HC. Stepwise adsorption in a mesoporous metal-organic framework: experimental and computational analysis. Chem Commun (Camb). 2012 Apr 04; 48(27):3297-9. PMID: 22358259.
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    17. Getman RB, Bae YS, Wilmer CE, Snurr RQ, Getman RB, Bae YS, Wilmer CE, Snurr RQ. Review and analysis of molecular simulations of methane, hydrogen, and acetylene storage in metal-organic frameworks. Chem Rev. 2012 Feb 08; 112(2):703-23. PMID: 22188435.
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    18. Xu Y, Getman RB, Shelton WA, Schneider WF, Xu Y, Getman RB, Shelton WA, Schneider WF. A first-principles investigation of the effect of Pt cluster size on CO and NO oxidation intermediates and energetics. Phys Chem Chem Phys. 2008 Oct 21; 10(39):6009-18. PMID: 18825289.
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