Thomas Patrick Senftle - Publications

Affiliations: 
Chemical Engineering Pennsylvania State University, State College, PA, United States 

17/31 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
2018 Lessio M, Senftle TP, Carter EA. Hydride Shuttle Formation and Reaction with CO2 on GaP(110). Chemsuschem. PMID 29624905 DOI: 10.1002/Cssc.201800037  0.96
2017 Senftle TP, Lessio M, Carter EA. The Role of Surface-Bound Dihydropyridine Analogues in Pyridine-Catalyzed CO2 Reduction over Semiconductor Photoelectrodes. Acs Central Science. 3: 968-974. PMID 28979938 DOI: 10.1021/Acscentsci.7B00233  0.96
2017 Senftle TP, Carter EA. The Holy Grail: Chemistry Enabling an Economically Viable CO2 Capture, Utilization, and Storage Strategy. Accounts of Chemical Research. 50: 472-475. PMID 28945424 DOI: 10.1021/Acs.Accounts.6B00479  0.96
2017 Senftle TP, Carter EA. Theoretical Determination of Band Edge Alignments at the Water-CuInS2(112) Semiconductor Interface. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 28544847 DOI: 10.1021/Acs.Langmuir.7B00668  0.96
2015 Strayer ME, Senftle TP, Winterstein JP, Vargas-Barbosa NM, Sharma R, Rioux RM, Janik MJ, Mallouk TE. Charge transfer stabilization of late transition metal oxide nanoparticles on a layered niobate support. Journal of the American Chemical Society. PMID 26651875 DOI: 10.1021/Jacs.5B11230  0.6
2015 Senftle TP, Van Duin ACT, Janik MJ. Role of Site Stability in Methane Activation on PdxCe1-xOδ Surfaces Acs Catalysis. 5: 6187-6199. DOI: 10.1021/Acscatal.5B00741  0.6
2015 Tavazza F, Senftle TP, Zou C, Becker CA, Van Duin ACT. Molecular dynamics investigation of the effects of tip-substrate interactions during nanoindentation Journal of Physical Chemistry C. 119: 13580-13589. DOI: 10.1021/acs.jpcc.5b01275  0.6
2014 Spanjers CS, Senftle TP, van Duin AC, Janik MJ, Frenkel AI, Rioux RM. Illuminating surface atoms in nanoclusters by differential X-ray absorption spectroscopy. Physical Chemistry Chemical Physics : Pccp. 16: 26528-38. PMID 25054561 DOI: 10.1039/C4Cp02146K  0.6
2014 Addou R, Senftle TP, O'Connor N, Janik MJ, van Duin AC, Batzill M. Influence of hydroxyls on Pd atom mobility and clustering on rutile TiO(2)(011)-2 × 1. Acs Nano. 8: 6321-33. PMID 24806092 DOI: 10.1021/Nn501817W  0.6
2014 Senftle TP, Janik MJ, Van Duin ACT. A ReaxFF investigation of hydride formation in palladium nanoclusters via Monte Carlo and molecular dynamics simulations Journal of Physical Chemistry C. 118: 4967-4981. DOI: 10.1021/Jp411015A  0.6
2014 Senftle TP, Van Duin ACT, Janik MJ. Determining in situ phases of a nanoparticle catalyst via grand canonical Monte Carlo simulations with the ReaxFF potential Catalysis Communications. 52: 72-77. DOI: 10.1016/J.Catcom.2013.12.001  0.6
2013 Senftle TP, Meyer RJ, Janik MJ, van Duin AC. Development of a ReaxFF potential for Pd∕O and application to palladium oxide formation. The Journal of Chemical Physics. 139: 044109. PMID 23901962 DOI: 10.1063/1.4815820  0.6
2013 Senftle TP, Meyer RJ, Janik MJ, Van Duin ACT. Development of a ReaxFF potential for Pd/O and application to palladium oxide formation Journal of Chemical Physics. 139. DOI: 10.1063/1.4815820  0.6
2012 Wu C, Senftle TP, Schneider WF. First-principles-guided design of ionic liquids for CO2 capture. Physical Chemistry Chemical Physics : Pccp. 14: 13163-70. PMID 22948394 DOI: 10.1039/c2cp41769c  0.6
2011 Hudgens JW, Pettibone JM, Senftle TP, Bratton RN. Reaction mechanism governing formation of 1,3-bis(diphenylphosphino)propane-protected gold nanoclusters. Inorganic Chemistry. 50: 10178-89. PMID 21928777 DOI: 10.1021/ic2018506  0.6
2011 Senftle TP, Mayernick A, Van Duin A, Janik M. Computational characterization of Pd/Ceria catalysts using DFT+U and ReaxFF 11aiche - 2011 Aiche Annual Meeting, Conference Proceedings 0.6
2010 Gurkan B, Goodrich BF, Mindrup EM, Ficke LE, Massel M, Seo S, Senftle TP, Wu H, Glaser MF, Shah JK, Maginn EJ, Brennecke JF, Schneider WF. Molecular design of high capacity, low viscosity, chemically tunable ionic liquids for CO2 capture Journal of Physical Chemistry Letters. 1: 3494-3499. DOI: 10.1021/Jz101533K  0.6
Low-probability matches
2017 Fantauzzi D, Krick Calderón S, Mueller JE, Grabau M, Papp C, Steinrück HP, Senftle TP, van Duin AC, Jacob T. Growth of Stable Surface Oxides on Pt(111) at Near-Ambient Pressures. Angewandte Chemie (International Ed. in English). PMID 28120368 DOI: 10.1002/Anie.201609317  0.28
2021 Wang P, Senftle TP. Theoretical insights into non-oxidative propane dehydrogenation over FeC. Physical Chemistry Chemical Physics : Pccp. PMID 33393543 DOI: 10.1039/d0cp04669h  0.01
2021 Zhu P, Xia C, Liu CY, Jiang K, Gao G, Zhang X, Xia Y, Lei Y, Alshareef HN, Senftle TP, Wang H. Direct and continuous generation of pure acetic acid solutions via electrocatalytic carbon monoxide reduction. Proceedings of the National Academy of Sciences of the United States of America. 118. PMID 33380454 DOI: 10.1073/pnas.2010868118  0.01
2020 Liu C, Zhang S, Martinez D, Li M, Senftle TP. Using statistical learning to predict interactions between single metal atoms and modified MgO(100) supports Npj Computational Materials. 6. DOI: 10.1038/s41524-020-00371-x  0.01
2019 Wang J, Liu C, Senftle TP, Zhu J, Zhang G, Guo X, Song C. Variation in the In2O3 Crystal Phase Alters Catalytic Performance toward the Reverse Water Gas Shift Reaction Acs Catalysis. 10: 3264-3273. DOI: 10.1021/acscatal.9b04239  0.01
2019 Clark CA, Reddy CP, Xu H, Heck KN, Luo G, Senftle TP, Wong MS. Mechanistic Insights into pH-Controlled Nitrite Reduction to Ammonia and Hydrazine over Rhodium Acs Catalysis. 10: 494-509. DOI: 10.1021/acscatal.9b03239  0.01
2019 Bhati M, Senftle TP. Identifying Adhesion Properties at Si/Polymer Interfaces with ReaxFF The Journal of Physical Chemistry C. 123: 27036-27047. DOI: 10.1021/acs.jpcc.9b08216  0.01
2018 O’Connor NJ, Jonayat ASM, Janik MJ, Senftle TP. Interaction trends between single metal atoms and oxide supports identified with density functional theory and statistical learning Nature Catalysis. 1: 531-539. DOI: 10.1038/s41929-018-0094-5  0.01
2018 Sai Gautam G, Senftle TP, Alidoust N, Carter EA. Novel Solar Cell Materials: Insights from First-Principles The Journal of Physical Chemistry C. 122: 27107-27126. DOI: 10.1021/Acs.Jpcc.8B08185  0.01
2018 Sai Gautam G, Senftle TP, Carter EA. Understanding the Effects of Cd and Ag Doping in Cu2ZnSnS4 Solar Cells Chemistry of Materials. 30: 4543-4555. DOI: 10.1021/Acs.Chemmater.8B00677  0.01
2016 Senftle TP, Hong S, Islam MM, Kylasa SB, Zheng Y, Shin YK, Junkermeier C, Engel-Herbert R, Janik MJ, Aktulga HM, Verstraelen T, Grama A, van Duin ACT. The ReaxFF reactive force-field: development, applications and future directions Npj Computational Materials. 2. DOI: 10.1038/npjcompumats.2015.11  0.01
2016 Lessio M, Senftle TP, Carter EA. Is the Surface Playing a Role during Pyridine-Catalyzed CO2 Reduction on p-GaP Photoelectrodes? Acs Energy Letters. 1: 464-468. DOI: 10.1021/Acsenergylett.6B00233  0.01
2016 Senftle TP, van Duin ACT, Janik MJ. Methane Activation at the Pd/CeO2 Interface Acs Catalysis. 7: 327-332. DOI: 10.1021/Acscatal.6B02447  0.01
2016 Senftle TP, Lessio M, Carter EA. Interaction of Pyridine and Water with the Reconstructed Surfaces of GaP(111) and CdTe(111) Photoelectrodes: Implications for CO2 Reduction Chemistry of Materials. 28: 5799-5810. DOI: 10.1021/Acs.Chemmater.6B02084  0.01
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