Mathew D. Halls, Ph.D. - Related publications

1997-2001 Chemistry Wayne State University, Detroit, MI, United States 
Theoretical chemistry
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50 most relevant papers in past 60 days:
Year Citation  Score
2020 Duverger E, Boyer AG, Sauriat-Dorizon H, Sonnet P, Stephan R, Hanf MC, Riedel D. 2D Functionalized Ultra-thin semi-insulating CaF layer on the Si(100) surface at low temperature (9K) for molecular electronic decoupling. Acs Applied Materials & Interfaces. PMID 32490659 DOI: 10.1021/acsami.0c06631   
2020 Ghosalya MK, Prabhakar Reddy K, Mhamane NB, Ranjan R, Gopinath CS. Gas-solid interactions with reactive and inert gas molecules by NAPUPS: can work function be a better descriptor of chemical reactivity? Physical Chemistry Chemical Physics : Pccp. 22: 15528-15540. PMID 32608404 DOI: 10.1039/d0cp02456b   
2020 Zhu L, Zhang Y, Zhang L, Zhou X, Jiang B. Unified and transferable description of dynamics of H dissociative adsorption on multiple copper surfaces via machine learning. Physical Chemistry Chemical Physics : Pccp. 22: 13958-13964. PMID 32609134 DOI: 10.1039/d0cp02291h   
2020 Cobley RJ, Kaya D, Palmer RE. Absence of non-local manipulation of oxygen atoms inserted below the Si(111)-7x7 surface. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 32568544 DOI: 10.1021/acs.langmuir.0c00058   
2020 Juurlink L, Auras SV, van Lent R, Bashlakov D, Piñeiros Bastidas JM, Roorda T, Rick S. Scaling Pt-catalyzed hydrogen dissociation on corrugated surfaces. Angewandte Chemie (International Ed. in English). PMID 32749736 DOI: 10.1002/anie.202005616   
2020 Koverga AA, Flórez E, Dorkis L, Rodriguez JA. Promoting effect of tungsten carbide on the catalytic activity of Cu for CO reduction. Physical Chemistry Chemical Physics : Pccp. PMID 32520058 DOI: 10.1039/d0cp00358a   
2020 Kamysbayev V, Filatov AS, Hu H, Rui X, Lagunas F, Wang D, Klie RF, Talapin DV. Covalent surface modifications and superconductivity of two-dimensional metal carbide MXenes. Science (New York, N.Y.). PMID 32616671 DOI: 10.1126/science.aba8311   
2020 Trujillo D, Ghosh A, Nakhmanson SM, Sahoo S, Alpay SP. Surface structure and energetics of low index facets of bismuth ferrite. Physical Chemistry Chemical Physics : Pccp. PMID 32657305 DOI: 10.1039/d0cp01575j   
2020 Mohammed MSG, Colazzo L, Gallardo A, Pomposo JA, Jelínek P, de Oteyza DG. Steering alkyne homocoupling with on-surface synthesized metal-organic complexes. Chemical Communications (Cambridge, England). PMID 32602478 DOI: 10.1039/d0cc03779f   
2020 Sha H, Liang S, Liu L, Cheng Z, Zhu J, Yu R. Surface termination and stoichiometry of LaAlO(001) surface studied by HRTEM. Micron (Oxford, England : 1993). 137: 102919. PMID 32763838 DOI: 10.1016/j.micron.2020.102919   
2020 Ram S, Lee SC, Bhattacharjee S. Adsorption energy scaling relation on bimetallic magnetic surfaces: role of surface magnetic moments. Physical Chemistry Chemical Physics : Pccp. PMID 32747888 DOI: 10.1039/d0cp01382j   
2020 Chen Q, Pei Y, Chen H, Song Y, Zhen L, Xu CY, Xiao P, Henkelman G. Highly reversible oxygen redox in layered compounds enabled by surface polyanions. Nature Communications. 11: 3411. PMID 32641725 DOI: 10.1038/s41467-020-17126-3   
2020 Barragan A, Sarasola A, Vitali L. Anisotropic electron conductance driven by reaction byproducts on a porous network of dibromobenzothiadiazole on Cu(110). Angewandte Chemie (International Ed. in English). PMID 32627891 DOI: 10.1002/anie.202008297   
2020 Maiti S, Sclar H, Rosy, Grinblat J, Talianker M, Burstein L, Noked M, Markovsky B, Aurbach D. Modification of Li- and Mn-Rich Cathode Materials Formation of the Rock-Salt and Spinel Surface Layers for Steady and High-Rate Electrochemical Performances. Acs Applied Materials & Interfaces. 12: 32698-32711. PMID 32660233 DOI: 10.1021/acsami.0c07497   
2020 Hafshejani TM, Wang W, Heggemann J, Nefedov A, Heissler S, Wang Y, Rahe P, Thissen P, Wöll C. CO adsorption on the calcite(10.4) surface: a combined experimental and theoretical study. Physical Chemistry Chemical Physics : Pccp. PMID 32643740 DOI: 10.1039/d0cp02698k   
2020 Falling LJ, Mom RV, Sandoval Diaz LE, Nakhaie S, Stotz E, Ivanov D, Hävecker M, Lunkenbein T, Knop-Gericke A, Schlögl R, Velasco-Vélez JJ. Graphene-capped liquid thin films for electrochemical operando X-ray spectroscopy and scanning electron microscopy. Acs Applied Materials & Interfaces. PMID 32702231 DOI: 10.1021/acsami.0c08379   
2020 Dzięgielewski W, Kowalczyk J, Kulczycki A, Madej M, Ozimina D. Tribochemical Interactions between Carbon Nanotubes and ZDDP Antiwear Additive during Tribofilm Formation on Uncoated and DLC-Coated Steel. Materials (Basel, Switzerland). 13. PMID 32456243 DOI: 10.3390/ma13102409   
2020 Zhang S, Han WQ. Recent advances in MXenes and their composites in lithium/sodium batteries from the viewpoints of components and interlayer engineering. Physical Chemistry Chemical Physics : Pccp. PMID 32692792 DOI: 10.1039/d0cp02275f   
2020 Gandhi M, Rajagopal D, Senthil Kumar A. Facile Electrochemical Demethylation of 2-Methoxyphenol to Surface-Confined Catechol on the MWCNT and Its Efficient Electrocatalytic Hydrazine Oxidation and Sensing Applications. Acs Omega. 5: 16208-16219. PMID 32656443 DOI: 10.1021/acsomega.0c01846   
2020 Velasco-Velez JJ, Mom RV, Sandoval-Diaz LE, Falling LJ, Chuang CH, Gao D, Jones TE, Zhu Q, Arrigo R, Roldan Cuenya B, Knop-Gericke A, Lunkenbein T, Schlögl R. Revealing the Active Phase of Copper during the Electroreduction of CO in Aqueous Electrolyte by Correlating X-ray Spectroscopy and Electron Microscopy. Acs Energy Letters. 5: 2106-2111. PMID 32551364 DOI: 10.1021/acsenergylett.0c00802   
2020 T AM, Kuriakose N, Mondal K, Ghosh P. CO capture, activation and dissociation on the TiC surface and TiC MXene: the role of surface structure. Physical Chemistry Chemical Physics : Pccp. PMID 32597914 DOI: 10.1039/d0cp01700k   
2020 Li X, Chen X, Zhang F, Zhang M, Zhang Q, Jia S. Energy Calculation and Simulation of Methane Adsorbed by Coal with Different Metamorphic Grades. Acs Omega. 5: 14976-14989. PMID 32637771 DOI: 10.1021/acsomega.0c00462   
2020 Jeong J, Hwang W. Preparation of a Highly Oleophobic Magnesium Alloy AZ31 Surface with Hierarchical Structure and Fluorination. Acs Omega. 5: 13860-13866. PMID 32566852 DOI: 10.1021/acsomega.0c01225   
2020 Ahmed MI, Liu C, Zhao Y, Ren W, Chen X, Chen S, Zhao C. Metal-sulfur linkages achieved by organic tethering of Ru nanocrystals for enhanced electrochemical nitrogen reduction. Angewandte Chemie (International Ed. in English). PMID 32767526 DOI: 10.1002/anie.202009435   
2020 Ahmed MI, Liu C, Zhao Y, Ren W, Chen X, Chen S, Zhao C. Metal-sulfur linkages achieved by organic tethering of Ru nanocrystals for enhanced electrochemical nitrogen reduction. Angewandte Chemie (International Ed. in English). PMID 32767526 DOI: 10.1002/anie.202009435   
2020 Bezerra RC, Mendes PCD, Passos RR, Da Silva JLF. Ab initio investigation of the role of transition-metal dopants in the adsorption properties of ethylene glycol on doped Pt(100) surfaces. Physical Chemistry Chemical Physics : Pccp. PMID 32724948 DOI: 10.1039/d0cp01403f   
2020 Zhang Y, Kong C, Davidsen RS, Scardera G, Duan L, Khoo KT, Payne DNR, Hoex B, Abbott M. 3D characterisation using plasma FIB-SEM: A large-area tomography technique for complex surfaces like black silicon. Ultramicroscopy. 218: 113084. PMID 32745881 DOI: 10.1016/j.ultramic.2020.113084   
2020 Kolmer M, Steiner AK, Izydorczyk I, Ko W, Engelund M, Szymonski M, Li AP, Amsharov K. Rational synthesis of atomically precise graphene nanoribbons directly on metal oxide surfaces. Science (New York, N.Y.). PMID 32586951 DOI: 10.1126/science.abb8880   
2020 Benedetti S, Righi G, Luches P, D'Addato S, Magri R, Selloni A. Surface Reactivity of Ag-Modified Ceria to Hydrogen: A Combined Experimental and Theoretical Investigation. Acs Applied Materials & Interfaces. 12: 27682-27690. PMID 32508088 DOI: 10.1021/acsami.0c03968   
2020 Bowker M, Hellier P, Decarolis D, Gianolio D, Mohammed KMH, Stenner A, Huthwelker T, Wells PP. Al-doped FeO as a support for molybdenum oxide methanol oxidation catalysts. Physical Chemistry Chemical Physics : Pccp. PMID 32469018 DOI: 10.1039/d0cp01192d   
2020 Schnell G, Polley C, Bartling S, Seitz H. Effect of Chemical Solvents on the Wetting Behavior Over Time of Femtosecond Laser Structured Ti6Al4V Surfaces. Nanomaterials (Basel, Switzerland). 10. PMID 32604739 DOI: 10.3390/nano10061241   
2020 Alberdi-Rodriguez J, Acharya SR, Rahman TS, Arnau Pino A, Gosalvez MA. Dominant contributions to the apparent activation energy in two-dimensional submonolayer growth: Comparison between Cu/Ni(111) and Ni/Cu(111). Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 32521520 DOI: 10.1088/1361-648X/ab9b50   
2020 Zhang M, Yin S, Chen Y. A DFT study for CO hydrogenation on W(111) and Ni-doped W(111) surfaces. Physical Chemistry Chemical Physics : Pccp. PMID 32686809 DOI: 10.1039/d0cp02285c   
2020 Liu Y, Xu C, Gu FL. Unraveling the enhancement mechanisms of HS sensing on a SnO surface: an ab initio perspective. Physical Chemistry Chemical Physics : Pccp. PMID 32597446 DOI: 10.1039/d0cp01853h   
2020 Sokolović I, Reticcioli M, Čalkovský M, Wagner M, Schmid M, Franchini C, Diebold U, Setvín M. Resolving the adsorption of molecular O on the rutile TiO(110) surface by noncontact atomic force microscopy. Proceedings of the National Academy of Sciences of the United States of America. PMID 32527857 DOI: 10.1073/pnas.1922452117   
2020 Qian J, Baskin A, Liu Z, Prendergast D, Crumlin EJ. Addressing the sensitivity of signals from solid/liquid ambient pressure XPS (APXPS) measurement. The Journal of Chemical Physics. 153: 044709. PMID 32752713 DOI: 10.1063/5.0006242   
2020 Sweetman A, Champness NR, Saywell A. On-surface chemical reactions characterised by ultra-high resolution scanning probe microscopy. Chemical Society Reviews. 49: 4189-4202. PMID 32510083 DOI: 10.1039/d0cs00166j   
2020 Voronina EN, Mankelevich YA, Novikov LS, Rakhimova TV, Marinov D, DeMarneffe JF. Mechanisms of hydrogen atom interactions with MoSmonolayer. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 32585649 DOI: 10.1088/1361-648X/aba013   
2020 Alba G, Villar MP, Alcántara R, Navas J, Araujo D. Surface States of (100) O-Terminated Diamond: Towards Other 1 × 1:O Reconstruction Models. Nanomaterials (Basel, Switzerland). 10. PMID 32570951 DOI: 10.3390/nano10061193   
2020 da Silva AL, Wu L, Caliman LB, Castro RHR, Navrotsky A, Gouvêa D. Energetics of CO and HO adsorption on alkaline earth metal doped TiO. Physical Chemistry Chemical Physics : Pccp. PMID 32613967 DOI: 10.1039/d0cp01787f   
2020 Quevedo W, Ontaneda J, Large A, Seymour JM, Bennett RA, Grau-Crespo R, Held G. Adsorption of Aspartic Acid on Ni{100}: A Combined Experimental and Theoretical Study. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 32706259 DOI: 10.1021/acs.langmuir.0c01175   
2020 Dokmai V, Kundhikanjana W, Chanlek N, Sinthiptharakoon K, Sae-Ueng U, Phuthong W, Pavarajarn V. Effects of catalyst surfaces on adsorption revealed by atomic force microscope force spectroscopy: photocatalytic degradation of diuron over zinc oxide. Physical Chemistry Chemical Physics : Pccp. 22: 15035-15047. PMID 32597447 DOI: 10.1039/d0cp02454f   
2020 Syafutra H, Yun JH, Yoshie Y, Lyu M, Takeda SN, Nakamura M, Wang L, Jung MC. Surface Degradation Mechanism on CHNHPbBr Hybrid Perovskite Single Crystal by a Grazing E-Beam Irradiation. Nanomaterials (Basel, Switzerland). 10. PMID 32605173 DOI: 10.3390/nano10071253   
2020 Niu Y, Huang X, Wang Y, Xu M, Chen J, Xu S, Willinger MG, Zhang W, Wei M, Zhang B. Manipulating interstitial carbon atoms in the nickel octahedral site for highly efficient hydrogenation of alkyne. Nature Communications. 11: 3324. PMID 32620829 DOI: 10.1038/s41467-020-17188-3   
2020 Kondati Natarajan S, Nolan M, Theofanis PL, Mokhtarzadeh CC, Clendenning S. Mechanism of Thermal Atomic Layer Etch of W metal using Sequential Oxidation and Chlorination: A First-Principles Study. Acs Applied Materials & Interfaces. PMID 32666796 DOI: 10.1021/acsami.0c06628   
2020 Hussain Z, Sultan N, Ali M, Naz MY, AbdEl-Salam NM, Ibrahim KA. Thermochemical Conversion of Waste Glass and Mollusk Shells into an Absorbent Material for Separation of Direct Blue 15 Azo Dye from Industrial Wastewater. Acs Omega. 5: 18114-18122. PMID 32743185 DOI: 10.1021/acsomega.0c01680   
2020 Pegg JT, Shields AE, Storr MT, Scanlon DO, de Leeuw NH. Interaction of hydrogen with actinide dioxide (011) surfaces. The Journal of Chemical Physics. 153: 014705. PMID 32640818 DOI: 10.1063/5.0010200   
2020 Lim CB, Park YJ. Precursor-based surface modification of cathodes using Ta and W for sulfide-based all-solid-state batteries. Scientific Reports. 10: 10501. PMID 32601283 DOI: 10.1038/s41598-020-67493-6   
2020 Wang R, Zhu B, Zhang G, Gao Y. Theoretical study of CO hydrogenation on Cu surfaces. Journal of Molecular Modeling. 26: 202. PMID 32648050 DOI: 10.1007/s00894-020-04448-8   
2020 Ortega E, Garcia-Martinez F, Garcia-Fernandez C, Simonovis JP, Hunt A, Walter A, Waluyo I, Bertram F, Merte L, Shipilin M, Pfaff S, Blomberg S, Zetterberg J, Gustafson J, Lundgren E, et al. Catalytic oxidation of CO on a curved Pt(111) surface: simultaneous ignition at all facets through a transient CO-O complex. Angewandte Chemie (International Ed. in English). PMID 32701180 DOI: 10.1002/anie.202007195