Thermoelectric Properties of Transition Metal Dichalcogenides: From Monolayers to Nanotubes KX Chen, XM Wang, DC Mo, SS Lyu Journal of Physical Chemistry C 119 (47), 26706–26711, 2015 | 98 | 2015 |
Redox‐Active Metaphosphate‐Like Terminals Enable High‐Capacity MXene Anodes for Ultrafast Na‐Ion Storage B Sun, Q Lu, K Chen, W Zheng, Z Liao, N Lopatik, D Li, M Hantusch, ... Advanced materials 34 (15), 2108682, 2022 | 97 | 2022 |
Excellent thermoelectric performance predicted in two-dimensional buckled antimonene: a first-principles study KX Chen, SS Lyu, XM Wang, YX Fu, Y Heng, DC Mo The Journal of Physical Chemistry C 121 (24), 13035-13042, 2017 | 86 | 2017 |
Superhydrophilic Nickel Nanoparticles with Core–Shell Structure To Decorate Copper Mesh for Efficient Oil/Water Separation ZY Luo, KX Chen, YQ Wang, JH Wang, DC Mo, SS Lyu Journal of Physical Chemistry C 120 (23), 12685–12692, 2016 | 69 | 2016 |
Hierarchical nanoparticle-induced superhydrophilic and under-water superoleophobic Cu foam with ultrahigh water permeability for effective oil/water separation ZY Luo, KX Chen, JH Wang, DC Mo, SS Lyu Journal of Materials Chemistry A 4, 10566-10574, 2016 | 68 | 2016 |
Predicted high thermoelectric performance in a two-dimensional indium telluride monolayer and its dependence on strain MS Li, KX Chen, DC Mo, SS Lyu Physical Chemistry Chemical Physics 21 (44), 24695-24701, 2019 | 34 | 2019 |
Quantum‐chemical study of the FeNCN conversion‐reaction mechanism in lithium‐and sodium‐ion batteries K Chen, M Fehse, A Laurita, JJ Arayamparambil, MT Sougrati, L Stievano, ... Angewandte Chemie International Edition 59 (9), 3718-3723, 2020 | 32 | 2020 |
WSe2 nanoribbons: new high-performance thermoelectric materials KX Chen, ZY Luo, DC Mo, SS Lyu Physical Chemistry Chemical Physics 18, 16337-16344, 2016 | 29 | 2016 |
Oxygen vacancies-rich iron-based perovskite-like electrodes for symmetrical solid oxide fuel cells Y Ling, T Li, Y Yang, Y Tian, X Wang, K Chen, D Dong, Y Chen, ... Ceramics International 47 (9), 12916-12925, 2021 | 26 | 2021 |
Optimized pseudopotentials and basis sets for semiempirical density functional theory for electrocatalysis applications WL Li, K Chen, E Rossomme, M Head-Gordon, T Head-Gordon The Journal of Physical Chemistry Letters 12 (42), 10304-10309, 2021 | 20 | 2021 |
First-principles study of divalent 3d transition-metal carbodiimides K Chen, R Dronskowski The Journal of Physical Chemistry A 123 (43), 9328-9335, 2019 | 19 | 2019 |
Nanostructural thermoelectric materials and their performance KX Chen, MS Li, DC Mo, SS Lyu Frontiers in Energy 12, 97-108, 2018 | 19 | 2018 |
A New Route for Surface Modification: Fluorine-Induced Superhydrophilicity ZY Luo, KX Chen, DC Mo, SS Lyu Journal of Physical Chemistry C 120 (22), 11882–11888, 2016 | 19 | 2016 |
Reversible high capacity and reaction mechanism of Cr2 (NCN) 3 negative electrodes for Li‐ion batteries JJ Arayamparambil, K Chen, A Iadecola, M Mann, X Qiao, B Fraisse, ... Energy Technology 8 (3), 1901260, 2020 | 18 | 2020 |
The birth and evolution of solvated electrons in the water F Novelli, K Chen, A Buchmann, T Ockelmann, C Hoberg, T Head-Gordon, ... Proceedings of the National Academy of Sciences 120 (8), e2216480120, 2023 | 17 | 2023 |
Critical role of thermal fluctuations for co binding on electrocatalytic metal surfaces WL Li, CN Lininger, K Chen, V Vaissier Welborn, E Rossomme, AT Bell, ... JACS Au 1 (10), 1708-1718, 2021 | 17 | 2021 |
Theoretical design of a new family of two-dimensional topological insulators KX Chen, SS Lyu, ZY Luo, YX Fu, Y Heng, DC Mo Physical Chemistry Chemical Physics 19 (11), 7481-7485, 2017 | 15 | 2017 |
Metal oxy-hydroxides with a hierarchical and hollow structure for highly efficient solar-thermal water evaporation ZY Luo, D Wang, KX Chen, L Huang, X Liu, Q Zhang, H Zhu, S Zhu ACS Applied Materials & Interfaces 13 (23), 27726-27733, 2021 | 14 | 2021 |
It's All in the (Cyanamide) Tilt: Synthesis and Structure of NaSc(NCN)2 AJ Corkett, K Chen, R Dronskowski European Journal of Inorganic Chemistry 2020 (27), 2596-2602, 2020 | 10 | 2020 |
The Good, the Bad, and the Ugly: Pseudopotential Inconsistency Errors in Molecular Applications of Density Functional Theory E Rossomme, LA Cunha, W Li, K Chen, AR McIsaac, T Head-Gordon, ... Journal of Chemical Theory and Computation 19 (10), 2827-2841, 2023 | 9 | 2023 |