Tuning the MoS 2 Edge-Site Activity for Hydrogen Evolution via Support Interactions

Special points for Brillouin-zone integrations

Monkhorst, H. J., & Pack, J. D. (1976) · Physical Review B · doi:10.1103/physrevb.13.5188 · Cited by 71,721 · see citing works

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

Giannozzi, P., Stefano Baroni, A., Bonini, N., Calandra, M., Car, R., Cavazzoni, C., Ceresoli, D., Chiarotti, G., Cococcioni, M., Dabo, I., et al. (2009) · Journal of Physics Condensed Matter · doi:10.1088/0953-8984/21/39/395502 · Cited by 29,336 · see citing works

Improved adsorption energetics within density-functional theory using revised Perdew-Burke-Ernzerhof functionals

Hammer, B., Hansen, L. B., & Nørskov, J. K. (1999) · Physical Review B · doi:10.1103/physrevb.59.7413 · Cited by 8,270 · see citing works

Trends in the exchange current for hydrogen evolution

Nørskov, J. K., Bligaard, T., Logadottir, A., Kitchin, J. R., Chen, J. G., Pandelov, S., & Stimming, U. (2005) · Journal of The Electrochemical Society · doi:10.1149/1.1856988 · Cited by 6,121 · see citing works

Identification of Active Edge Sites for Electrochemical H ₂ Evolution from MoS ₂ Nanocatalysts

Jaramillo, T. F., Jørgensen, K. P., Bonde, J., Nielsen, J. H., Horch, S., & Chorkendorff, I. (2007) · Science · doi:10.1126/science.1141483 · Cited by 6,100 · see citing works

MoS ₂ Nanoparticles Grown on Graphene: An Advanced Catalyst for the Hydrogen Evolution Reaction

Li, Y., Wang, H., Xie, L., Liang, Y., Hong, G., & Dai, H. (2011) · Journal of the American Chemical Society · doi:10.1021/ja201269b · Cited by 5,001 · see citing works

Alternative energy technologies

Dresselhaus, M. S., & Thomas, I. L. (2001) · Nature · doi:10.1038/35104599 · Cited by 4,894 · see citing works

Computational high-throughput screening of electrocatalytic materials for hydrogen evolution

Greeley, J., Jaramillo, T. F., Bonde, J., Chorkendorff, I., & Nørskov, J. K. (2006) · Nature Materials · doi:10.1038/nmat1752 · Cited by 4,097 · see citing works

Biomimetic Hydrogen Evolution:  MoS ₂ Nanoparticles as Catalyst for Hydrogen Evolution

Hinnemann, B., Moses, P. G., Bonde, J., Jørgensen, K. P., Nielsen, J. H., Horch, S., Chorkendorff, I., & Nørskov, J. K. (2005) · Journal of the American Chemical Society · doi:10.1021/ja0504690 · Cited by 4,065 · see citing works

Theoretical surface science and catalysis—calculations and concepts

Hammer, B., & Nørskov, J. K. (2000) · Advances in Catalysis · doi:10.1016/s0360-0564(02)45013-4 · Cited by 3,972 · see citing works

Nitrogen-Doped Graphene as Efficient Metal-Free Electrocatalyst for Oxygen Reduction in Fuel Cells

Qu, L., Liu, Y., Baek, J., & Dai, L. (2010) · ACS Nano · doi:10.1021/nn901850u · Cited by 3,954 · see citing works

Engineering the surface structure of MoS2 to preferentially expose active edge sites for electrocatalysis

Kibsgaard, J., Chen, Z., Reinecke, B. N., & Jaramillo, T. F. (2012) · Nature Materials · doi:10.1038/nmat3439 · Cited by 3,234 · see citing works

Electronic factors determining the reactivity of metal surfaces

Hammer, B., & Nørskov, J. K. (1995) · Surface Science · doi:10.1016/0039-6028(96)80007-0 · Cited by 2,891 · see citing works

Synthesis of MoS ₂ and MoSe ₂ Films with Vertically Aligned Layers

Kong, D., Wang, H., Cha, J. J., Pasta, M., Koski, K. J., Yao, J., & Cui, Y. (2013) · Nano Letters · doi:10.1021/nl400258t · Cited by 2,250 · see citing works

Density functionals for surface science: Exchange-correlation model development with Bayesian error estimation

Wellendorff, J., Lundgaard, K. T., Møgelhøj, A., Petzold, V., Landis, D. D., Nørskov, J. K., Bligaard, T., & Jacobsen, K. W. (2012) · Physical Review B · doi:10.1103/physrevb.85.235149 · Cited by 1,450 · see citing works

Molybdenum sulfides—efficient and viable materials for electro - and photoelectrocatalytic hydrogen evolution

Laursen, A. B., Kegnæs, S., Dahl, S., & Chorkendorff, I. (2012) · Energy & Environmental Science · doi:10.1039/c2ee02618j · Cited by 1,348 · see citing works

Modeling the Electrochemical Hydrogen Oxidation and Evolution Reactions on the Basis of Density Functional Theory Calculations

Skúlason, E., Tripkovic, V., Björketun, M. E., Gudmundsdóttir, S., Karlberg, G., Rossmeisl, J., Bligaard, T., Jónsson, H., & Nørskov, J. K. (2010) · The Journal of Physical Chemistry C · doi:10.1021/jp1048887 · Cited by 1,271 · see citing works

A Molecular MoS ₂ Edge Site Mimic for Catalytic Hydrogen Generation

Karunadasa, H. I., Montalvo, E., Sun, Y., Majda, M., Long, J. R., & Chang, C. J. (2012) · Science · doi:10.1126/science.1215868 · Cited by 1,215 · see citing works

MoS 2 Nanoplates Consisting of Disordered Graphene-like Layers for High Rate Lithium Battery Anode Materials

Hwang, H., Kim, H., & Cho, J. (2011) · Nano Letters · doi:10.1021/nl202675f · Cited by 1,067 · see citing works

The rate of electrolytic hydrogen evolution and the heat of adsorption of hydrogen

Parsons, R. (1958) · Transactions of the Faraday Society · doi:10.1039/tf9585401053 · Cited by 1,039 · see citing works

Graphene on metal surfaces

Wintterlin, J., & Bocquet, M. (2009) · Surface Science · doi:10.1016/j.susc.2008.08.037 · Cited by 988 · see citing works

Density functional theory calculations for the hydrogen evolution reaction in an electrochemical double layer on the Pt(111) electrode

Skúlason, E., Karlberg, G. S., Rossmeisl, J., Bligaard, T., Greeley, J., Jónsson, H., & Nørskov, J. K. (2007) · Physical Chemistry Chemical Physics · doi:10.1039/b700099e · Cited by 911 · see citing works

Untitled work

(2000) · doi:10.1103/physrevlett.84.951 · Cited by 868 · see citing works

Hydrogen evolution on nano-particulate transition metal sulfides

Bonde, J., Moses, P. G., Jaramillo, T. F., Nørskov, J. K., & Chorkendorff, I. (2008) · Faraday Discussions · doi:10.1039/b803857k · Cited by 805 · see citing works

Van der Waals Density Functional for Layered Structures

Rydberg, H., Dion, M., Jacobson, N., Schröder, E., Hyldgaard, P., Simak, S. I., Langreth, D. C., & Lundqvist, B. I. (2003) · Physical Review Letters · doi:10.1103/physrevlett.91.126402 · Cited by 703 · see citing works

Work function, electronegativity, and electrochemical behaviour of metals

Trasatti, S. (1971) · Journal of Electroanalytical Chemistry · doi:10.1016/s0022-0728(71)80123-7 · Cited by 661 · see citing works

One-Dimensional Metallic Edge States in MoS 2

Bollinger, M. V., Lauritsen, J. V., Jacobsen, K. W., Nørskov, J. K., Helveg, S., & Besenbacher, F. (2001) · Physical Review Letters · doi:10.1103/physrevlett.87.196803 · Cited by 627 · see citing works

The role of defects and doping in 2D graphene sheets and 1D nanoribbons

Terrones, H., Lv, R., Terrones, M., & Dresselhaus, M. S. (2012) · Reports on Progress in Physics · doi:10.1088/0034-4885/75/6/062501 · Cited by 624 · see citing works

Graphene on metals: A van der Waals density functional study

Vanin, M., Mortensen, J. J., Kelkkanen, A. K., García-Lastra, J. M., Thygesen, K. S., & Jacobsen, K. W. (2010) · Physical Review B · doi:10.1103/physrevb.81.081408 · Cited by 497 · see citing works

Atomic-scale insight into structure and morphology changes of MoS2 nanoclusters in hydrotreating catalysts

Lauritsen, J. V., Bollinger, M. V., Lægsgaard, E., Jacobsen, K. W., Nørskov, J. K., Clausen, B., Topsøe, H., & Besenbacher, F. (2003) · Journal of Catalysis · doi:10.1016/j.jcat.2003.09.015 · Cited by 436 · see citing works

DFT Calculations of Unpromoted and Promoted MoS2-Based Hydrodesulfurization Catalysts

Byskov, L. S., Nørskov, J. K., Clausen, B. S., & Topsøe, H. (1999) · Journal of Catalysis · doi:10.1006/jcat.1999.2598 · Cited by 434 · see citing works

Characterization of the structures and active sites in sulfided Co$z.sbnd;Mo/Al2O3 and Ni$z.sbnd;Mo/Al2O3 catalysts by NO chemisorption

Topsøe, N. (1983) · Journal of Catalysis · doi:10.1016/0021-9517(83)90010-6 · Cited by 432 · see citing works

Atomic and electronic structure of MoS2 nanoparticles

Bollinger, M. V., Jacobsen, K. W., & Nørskov, J. K. (2003) · Physical review. B, Condensed matter · doi:10.1103/physrevb.67.085410 · Cited by 398 · see citing works

Structure, Energetics, and Electronic Properties of the Surface of a Promoted MoS2 Catalyst: An ab Initio Local Density Functional Study

Raybaud, P., Häfner, J., Kresse, G., Kasztelan, S., & Toulhoat, H. (2000) · Journal of Catalysis · doi:10.1006/jcat.1999.2743 · Cited by 344 · see citing works

Nanoengineering Defect Structures on Graphene

Lusk, M. T., & Carr, L. D. (2008) · Physical Review Letters · doi:10.1103/physrevlett.100.175503 · Cited by 342 · see citing works

Recent STM, DFT and HAADF-STEM studies of sulfide-based hydrotreating catalysts: Insight into mechanistic, structural and particle size effects

Besenbacher, F., Brorson, M., Clausen, B., Helveg, S., Hinnemann, B., Kibsgaard, J., Lauritsen, J. V., Moses, P. G., Nørskov, J. K., & Topsøe, H. (2007) · Catalysis Today · doi:10.1016/j.cattod.2007.08.009 · Cited by 302 · see citing works

Structure and properties of molybdenum sulfide: Correlation of O2 chemisorption with hydrodesulfurization activity*1

TAUSTER, S. (1980) · Journal of Catalysis · doi:10.1016/0021-9517(80)90109-8 · Cited by 237 · see citing works

Sulfur-doped graphene as a potential alternative metal-free electrocatalyst and Pt-catalyst supporting material for oxygen reduction reaction

Park, J., Jang, Y. J., Kim, Y. J., Song, M.-S., Yoon, S., Kim, D. H., & Kim, S. (2013) · Physical Chemistry Chemical Physics · doi:10.1039/c3cp54311k · Cited by 228 · see citing works

Cluster−Support Interactions and Morphology of MoS2 Nanoclusters in a Graphite-Supported Hydrotreating Model Catalyst

Kibsgaard, J., Lauritsen, J. V., Lægsgaard, E., Clausen, B. S., Topsøe, H., & Besenbacher, F. (2006) · Journal of the American Chemical Society · doi:10.1021/ja0651106 · Cited by 182 · see citing works

CO and CO2 Hydrogenation to Methanol Calculated Using the BEEF-vdW Functional

Studt, F., Abild‐Pedersen, F., Varley, J. B., & Nørskov, J. K. (2012) · Catalysis Letters · doi:10.1007/s10562-012-0947-5 · Cited by 177 · see citing works

The adsorption and binding of thiophene, butene and H2S on the basal plane of MoS2 single crystals

Salmerón, M., Somorjai, G. A., Wold, A., Chianelli, R. R., & Liang, K. S. (1982) · Chemical Physics Letters · doi:10.1016/0009-2614(82)83620-8 · Cited by 173 · see citing works

Bridge structure for the graphene/Ni(111) system: A first principles study

Fuentes‐Cabrera, M., Baskes, M. I., Melechko, A. V., & Simpson, M. L. (2008) · Physical Review B · doi:10.1103/physrevb.77.035405 · Cited by 173 · see citing works

The morphology of MoS2, WS2, Co–Mo–S, Ni–Mo–S and Ni–W–S nanoclusters in hydrodesulfurization catalysts revealed by HAADF-STEM

Brorson, M., Carlsson, A., & Topsøe, H. (2007) · Catalysis Today · doi:10.1016/j.cattod.2007.01.073 · Cited by 145 · see citing works

Edge termination of MoS2 and CoMoS catalyst particles

Byskov, L. S., Nørskov, J. K., Clausen, B. S., & Topsøe, H. (2000) · Catalysis Letters · doi:10.1023/a:1019063709813 · Cited by 145 · see citing works

Density functional study of the adsorption and van der Waals binding of aromatic and conjugated compounds on the basal plane of MoS2

Moses, P. G., Mortensen, J. J., Lundqvist, B. I., & Nørskov, J. K. (2009) · The Journal of Chemical Physics · doi:10.1063/1.3086040 · Cited by 127 · see citing works

On the Role of Metal Step-Edges in Graphene Growth

Saadi, S., Abild‐Pedersen, F., Helveg, S., Sehested, J., Hinnemann, B., Appel, C. C., & Nørskov, J. K. (2010) · The Journal of Physical Chemistry C · doi:10.1021/jp1033596 · Cited by 119 · see citing works

Bridging the Gap Between Bulk and Nanostructured Photoelectrodes: The Impact of Surface States on the Electrocatalytic and Photoelectrochemical Properties of MoS2

Chen, Z., Forman, A. J., & Jaramillo, T. F. (2013) · The Journal of Physical Chemistry C · doi:10.1021/jp311375k · Cited by 104 · see citing works

Advances in Electrochemical Science and Engineering

(1991) · Advances in electrochemical science and engineering · doi:10.1002/9783527616763 · Cited by 96 · see citing works

Modeling van der Waals Interactions in Zeolites with Periodic DFT: Physisorption of n-Alkanes in ZSM-22

Brogaard, R. Y., Moses, P. G., & Nørskov, J. K. (2012) · Catalysis Letters · doi:10.1007/s10562-012-0870-9 · Cited by 65 · see citing works

Structure characterization and conductive performance of polypyrrol‐molybdenum disulfide intercalation materials

Wang, T., Liu, W., Tian, J. S., Shao, X., & Sun, D. (2004) · Polymer Composites · doi:10.1002/pc.20009 · Cited by 51 · see citing works

Recent Advances in Electrocatalytic Hydrogen Evolution Using Nanoparticles

Zhu, J., Hu, L., Zhao, P., Lee, L. Y. S., & Wong, K.-Y. (2020) · Chemical Reviews · doi:10.1021/acs.chemrev.9b00248 · Cited by 3,133 · see citing works

Activating and optimizing MoS2 basal planes for hydrogen evolution through the formation of strained sulphur vacancies

Li, H., Tsai, C., Koh, A. L., Cai, L., Contryman, A. W., Fragapane, A. H., Zhao, J., Han, H. S., Manoharan, H. C., Abild-Pedersen, F., et al. (2016) · Nature Materials · doi:10.1038/nmat4465 · Cited by 2,529 · see citing works

Advancing the Electrochemistry of the Hydrogen‐Evolution Reaction through Combining Experiment and Theory

Zheng, Y., Jiao, Y., Jaroniec, M., & Qiao, S. Z. (2015) · Angewandte Chemie International Edition · doi:10.1002/anie.201407031 · Cited by 2,046 · see citing works

Emerging Two-Dimensional Nanomaterials for Electrocatalysis

Jin, H., Guo, C., Liu, X., Liu, J., Vasileff, A., Jiao, Y., Zheng, Y., & Qiao, S. (2018) · Chemical Reviews · doi:10.1021/acs.chemrev.7b00689 · Cited by 2,030 · see citing works

Catalyzing the hydrogen evolution reaction (HER) with molybdenum sulfide nanomaterials

Benck, J. D., Hellstern, T. R., Kibsgaard, J., Chakthranont, P., & Jaramillo, T. F. (2014) · ACS Catalysis · doi:10.1021/cs500923c · Cited by 1,617 · see citing works

2D Transition‐Metal‐Dichalcogenide‐Nanosheet‐Based Composites for Photocatalytic and Electrocatalytic Hydrogen Evolution Reactions

Lu, Q., Yu, Y., Ma, Q., Chen, B., & Zhang, H. (2016) · Advanced Materials · doi:10.1002/adma.201503270 · Cited by 1,447 · see citing works

Triggering the electrocatalytic hydrogen evolution activity of the inert two-dimensional MoS 2 surface via single-atom metal doping

Deng, J., Li, H., Xiao, J., Tu, Y., Deng, D., Yang, H., Tian, H., Li, J., Ren, P., & Bao, X. (2015) · Energy & Environmental Science · doi:10.1039/c5ee00751h · Cited by 1,339 · see citing works

Earth-abundant inorganic electrocatalysts and their nanostructures for energy conversion applications

Faber, M. S., & Jin, S. (2014) · Energy Environ. Sci. · doi:10.1039/c4ee01760a · Cited by 1,317 · see citing works

Defects Engineered Monolayer MoS 2 for Improved Hydrogen Evolution Reaction

Ye, G., Gong, Y., Lin, J., Li, B., He, Y., Pantelides, S. T., Zhou, W., Vajtai, R., & Ajayan, P. M. (2016) · Nano Letters · doi:10.1021/acs.nanolett.5b04331 · Cited by 1,190 · see citing works

2D MXenes: A New Family of Promising Catalysts for the Hydrogen Evolution Reaction

Gao, G., O’Mullane, A. P., & Du, A. (2017) · ACS Catalysis · doi:10.1021/acscatal.6b02754 · Cited by 1,153 · see citing works

Regulation of Coordination Number over Single Co Sites: Triggering the Efficient Electroreduction of CO2

Wang, X., Zhao, C., Zhao, X., Yao, T., Chen, W., You, R., Zhao, C., Wu, G., Wang, J., Huang, W., et al. (2017) · Angewandte Chemie International Edition · doi:10.1002/anie.201712451 · Cited by 1,119 · see citing works

Advances and Challenges for the Electrochemical Reduction of CO 2 to CO: From Fundamentals to Industrialization

Jin, S., Hao, Z., Zhang, K., Yan, Z., & Chen, J. (2021) · Angewandte Chemie International Edition · doi:10.1002/anie.202101818 · Cited by 1,027 · see citing works

Recent Strategies for Improving the Catalytic Activity of 2D TMD Nanosheets Toward the Hydrogen Evolution Reaction

Voiry, D., Yang, J., & Chhowalla, M. (2016) · Advanced Materials · doi:10.1002/adma.201505597 · Cited by 949 · see citing works

Support and Interface Effects in Water‐Splitting Electrocatalysts

Zhang, J., Zhang, Q., & Feng, X. (2019) · Advanced Materials · doi:10.1002/adma.201808167 · Cited by 916 · see citing works

Nanostructured transition metal dichalcogenide electrocatalysts for CO 2 reduction in ionic liquid

Asadi, M., Kim, K., Liu, C., Addepalli, V. A., Abbasi, P., Yasaei, P., Phillips, P., Behranginia, A., Cerrato, J. M., Haasch, R. T., et al. (2016) · Science · doi:10.1126/science.aaf4767 · Cited by 903 · see citing works

Recent Development of Molybdenum Sulfides as Advanced Electrocatalysts for Hydrogen Evolution Reaction

Yan, Y., Xia, B., Xu, Z., & Wang, X. (2014) · ACS Catalysis · doi:10.1021/cs500070x · Cited by 868 · see citing works

Mechanism of Hydrogen Evolution Reaction on 1T-MoS 2 from First Principles

Tang, Q. H., & Jiang, D. (2016) · ACS Catalysis · doi:10.1021/acscatal.6b01211 · Cited by 864 · see citing works

Low-dimensional catalysts for hydrogen evolution and CO2 reduction

Voiry, D., Shin, H. S., Loh, K. P., & Chhowalla, M. (2018) · Nature Reviews Chemistry · doi:10.1038/s41570-017-0105 · Cited by 850 · see citing works

Electrocatalysts for hydrogen evolution reaction

Eftekhari, A. (2017) · International Journal of Hydrogen Energy · doi:10.1016/j.ijhydene.2017.02.125 · Cited by 833 · see citing works

All The Catalytic Active Sites of MoS ₂ for Hydrogen Evolution

Li, G., Zhang, D., Qiao, Q., Yu, Y., Peterson, D., Zafar, A., Kumar, R., Curtarolo, S., Hunte, F., Shannon, S., et al. (2016) · Journal of the American Chemical Society · doi:10.1021/jacs.6b05940 · Cited by 829 · see citing works

The role of electronic coupling between substrate and 2D MoS2 nanosheets in electrocatalytic production of hydrogen

Voiry, D., Fullon, R., Yang, J., de Carvalho Castro e Silva, C., Kappera, R., Bozkurt, I., Kaplan, D., Lagos, M. J., Batson, P. E., Gupta, G., et al. (2016) · Nature Materials · doi:10.1038/nmat4660 · Cited by 824 · see citing works

Electrocatalysts for the generation of hydrogen, oxygen and synthesis gas

Sapountzi, F. M., Gracia, J. M., Weststrate, C. J., Fredriksson, H. O. A., & Niemantsverdriet, J. W. (2016) · Progress in Energy and Combustion Science · doi:10.1016/j.pecs.2016.09.001 · Cited by 772 · see citing works

Electrochemical generation of sulfur vacancies in the basal plane of MoS2 for hydrogen evolution

Tsai, C., Li, H., Park, S., Park, J., Han, H. S., Nørskov, J. K., Zheng, X., & Abild‐Pedersen, F. (2017) · Nature Communications · doi:10.1038/ncomms15113 · Cited by 765 · see citing works

Sulfur vacancy-rich MoS2 as a catalyst for the hydrogenation of CO2 to methanol

Hu, J., Yu, L., Deng, J., Wang, Y., Cheng, K., Ma, C., Zhang, Q., Wen, W., Yu, S., Pan, Y., et al. (2021) · Nature Catalysis · doi:10.1038/s41929-021-00584-3 · Cited by 744 · see citing works

Edge-terminated molybdenum disulfide with a 9.4-Å interlayer spacing for electrochemical hydrogen production

Gao, M.-R., Chan, M. K. Y., & Sun, Y. (2015) · Nature Communications · doi:10.1038/ncomms8493 · Cited by 736 · see citing works

Hollow Mo-doped CoP nanoarrays for efficient overall water splitting

Guan, C., Xiao, W., Wu, H., Liu, X., Zang, W., Zhang, H., Ding, J., Feng, Y. P., Pennycook, S. J., & Wang, J. (2018) · Nano Energy · doi:10.1016/j.nanoen.2018.03.034 · Cited by 713 · see citing works

Transition-metal doped edge sites in vertically aligned MoS2 catalysts for enhanced hydrogen evolution

Wang, H., Tsai, C., Kong, D., Chan, K., Abild‐Pedersen, F., Nørskov, J. K., & Cui, Y. (2015) · Nano Research · doi:10.1007/s12274-014-0677-7 · Cited by 664 · see citing works

Two-dimensional layered MoS 2 : rational design, properties and electrochemical applications

Zhang, G., Liu, H., Qu, J., & Li, J. (2016) · Energy & Environmental Science · doi:10.1039/c5ee03761a · Cited by 642 · see citing works

Chemically activating MoS2 via spontaneous atomic palladium interfacial doping towards efficient hydrogen evolution

Luo, Z., Ouyang, Y., Zhang, H., Xiao, M., Ge, J., Jiang, Z. R., Wang, J., Tang, D., Cao, X., Liu, C., et al. (2018) · Nature Communications · doi:10.1038/s41467-018-04501-4 · Cited by 642 · see citing works

Electrochemical Tuning of MoS2 Nanoparticles on Three-Dimensional Substrate for Efficient Hydrogen Evolution

Wang, H., Lu, Z., Kong, D., Sun, J., Hymel, T. M., & Cui, Y. (2014) · ACS Nano · doi:10.1021/nn500959v · Cited by 611 · see citing works

Multiscale structural and electronic control of molybdenum disulfide foam for highly efficient hydrogen production

Deng, J., Li, H., Wang, S.-H., Ding, D., Chen, M., Liu, C., Tian, Z., Novoselov, K. S., Ma, C., Deng, D., et al. (2017) · Nature Communications · doi:10.1038/ncomms14430 · Cited by 570 · see citing works

Nanomaterials for photoelectrochemical water splitting – review

Joy, J., Mathew, J., & George, S. C. (2018) · International Journal of Hydrogen Energy · doi:10.1016/j.ijhydene.2018.01.099 · Cited by 567 · see citing works

Design concept for electrocatalysts

Wang, Y., Zheng, X., & Wang, D. S. (2021) · Nano Research · doi:10.1007/s12274-021-3794-0 · Cited by 549 · see citing works

A Comprehensive Review of Materials with Catalytic Effects in Li–S Batteries: Enhanced Redox Kinetics

Lim, W., Kim, S., Jo, C., & Lee, J. (2019) · Angewandte Chemie International Edition · doi:10.1002/anie.201902413 · Cited by 535 · see citing works

Atomically engineering activation sites onto metallic 1T-MoS2 catalysts for enhanced electrochemical hydrogen evolution

Huang, Y., Sun, Y., Zheng, X. R., Aoki, T., Pattengale, B., Huang, J., He, X., Bian, W., Younan, S. M., Williams, N., et al. (2019) · Nature Communications · doi:10.1038/s41467-019-08877-9 · Cited by 521 · see citing works

Nanostructured Metal Chalcogenides for Energy Storage and Electrocatalysis

Zhang, Y., Zhou, Q., Zhu, J., Yan, Q., Dou, S. X., & Sun, W. (2017) · Advanced Functional Materials · doi:10.1002/adfm.201702317 · Cited by 520 · see citing works

Precious Metal Free Hydrogen Evolution Catalyst Design and Application

Feidenhans'l, A. A., Regmi, Y. N., Wei, C., Xia, D., Kibsgaard, J., & King, L. A. (2024) · Chemical Reviews · doi:10.1021/acs.chemrev.3c00712 · Cited by 516 · see citing works

Active edge sites in MoSe ₂ and WSe ₂ catalysts for the hydrogen evolution reaction: a density functional study

Tsai, C., Chan, K., Abild-Pedersen, F., & Nørskov, J. K. (2014) · Phys. Chem. Chem. Phys. · doi:10.1039/c4cp01237b · Cited by 494 · see citing works

New two-dimensional transition metal borides for Li ion batteries and electrocatalysis

Guo, Z., Zhou, J., & Sun, Z. (2017) · Journal of Materials Chemistry A · doi:10.1039/c7ta08665b · Cited by 471 · see citing works

Ultrathin N-Doped Mo 2 C Nanosheets with Exposed Active Sites as Efficient Electrocatalyst for Hydrogen Evolution Reactions

Jia, J. F., Xiong, T., Zhao, L., Wang, F., Liu, H., Hu, R., Zhou, J. F., Zhou, W., & Chen, S. W. (2017) · ACS Nano · doi:10.1021/acsnano.7b06607 · Cited by 469 · see citing works

Controllable growth and transfer of monolayer MoS2 on Au foils and its potential application in hydrogen evolution reaction

Shi, J., Ma, D., Han, G.-F., Zhang, Y., Ji, Q., Gao, T., Sun, J., Song, X., Li, C., Zhang, Y., et al. (2014) · ACS Nano · doi:10.1021/nn503211t · Cited by 459 · see citing works

Rational Design of Better Hydrogen Evolution Electrocatalysts for Water Splitting: A Review

Liu, F., Shi, C., Guo, X., He, Z., Pan, L., Huang, Z., Zhang, X., & Zou, J. (2022) · Advanced Science · doi:10.1002/advs.202200307 · Cited by 455 · see citing works

Recent advances and fundamentals of Pseudocapacitors: Materials, mechanism, and its understanding

Bhojane, P. (2021) · Journal of Energy Storage · doi:10.1016/j.est.2021.103654 · Cited by 448 · see citing works

Molybdenum disulfide nanomaterials: Structures, properties, synthesis and recent progress on hydrogen evolution reaction

He, Z., & Que, W. (2016) · Applied Materials Today · doi:10.1016/j.apmt.2016.02.001 · Cited by 438 · see citing works

Self-optimizing, highly surface-active layered metal dichalcogenide catalysts for hydrogen evolution

Liu, Y., Wu, J., Hackenberg, K., Zhang, J., Wang, Y., Yang, Y., Keyshar, K., Gu, J. H., Ogitsu, T., Vajtai, R., et al. (2017) · Nature Energy · doi:10.1038/nenergy.2017.127 · Cited by 429 · see citing works

Recent Progress in CVD Growth of 2D Transition Metal Dichalcogenides and Related Heterostructures

Zhang, Y., Yao, Y., Sendeku, M. G., Yin, L., Zhan, X., Wang, F., Wang, Z., & He, J. (2019) · Advanced Materials · doi:10.1002/adma.201901694 · Cited by 425 · see citing works

Interlayer Nanoarchitectonics of Two‐Dimensional Transition‐Metal Dichalcogenides Nanosheets for Energy Storage and Conversion Applications

Xu, J., Zhang, J., Zhang, W., & Lee, C. (2017) · Advanced Energy Materials · doi:10.1002/aenm.201700571 · Cited by 409 · see citing works

Group 6 transition metal dichalcogenide nanomaterials: synthesis, applications and future perspectives

Samadi, M., Sarikhani, N., Zirak, M., Zhang, H., Zhang, H.-L., & Moshfegh, A. Z. (2018) · Nanoscale Horizons · doi:10.1039/c7nh00137a · Cited by 408 · see citing works

Roadmap and Direction toward High-Performance MoS ₂ Hydrogen Evolution Catalysts

Cao, Y. (2021) · ACS Nano · doi:10.1021/acsnano.1c01879 · Cited by 405 · see citing works

Ultrahigh-current-density niobium disulfide catalysts for hydrogen evolution

Yang, J., Mohmad, A. R., Wang, Y., Fullon, R., Song, X., Zhao, F., Bozkurt, I., Augustin, M., Santos, E. J. G., Shin, H. S., et al. (2019) · Nature Materials · doi:10.1038/s41563-019-0463-8 · Cited by 401 · see citing works

Prediction of Enhanced Catalytic Activity for Hydrogen Evolution Reaction in Janus Transition Metal Dichalcogenides

Er, D., Ye, H., Frey, N. C., Kumar, H., Lou, J., & Shenoy, V. B. (2018) · Nano Letters · doi:10.1021/acs.nanolett.8b01335 · Cited by 401 · see citing works

Theoretical insights into the hydrogen evolution activity of layered transition metal dichalcogenides

Tsai, C., Chan, K., Nørskov, J. K., & Abild‐Pedersen, F. (2015) · Surface Science · doi:10.1016/j.susc.2015.01.019 · Cited by 395 · see citing works

Surface Modulation of Hierarchical MoS ₂ Nanosheets by Ni Single Atoms for Enhanced Electrocatalytic Hydrogen Evolution

Zhang, H., Yu, L., Chen, T., Zhou, W., & Lou, X. W. (. (2018) · Advanced Functional Materials · doi:10.1002/adfm.201807086 · Cited by 395 · see citing works

Enabling Silicon for Solar-Fuel Production

Sun, K., Shen, S., Liang, Y., Burrows, P. E., Mao, S. S., & Wang, D. (2014) · Chemical Reviews · doi:10.1021/cr300459q · Cited by 393 · see citing works

Structural and Electronic Optimization of MoS ₂ Edges for Hydrogen Evolution

Wang, H., Xiao, X., Liu, S., Chiang, C.-L., Kuai, X., Peng, C.-K., Lin, Y.-C., Meng, X., Zhao, J., Choi, J., et al. (2019) · Journal of the American Chemical Society · doi:10.1021/jacs.9b09932 · Cited by 383 · see citing works

Interlayer-expanded MoS 2

Rasamani, K. D., Alimohammadi, F., & Sun, Y. (2016) · Materials Today · doi:10.1016/j.mattod.2016.10.004 · Cited by 379 · see citing works

P Dopants Triggered New Basal Plane Active Sites and Enlarged Interlayer Spacing in MoS 2 Nanosheets toward Electrocatalytic Hydrogen Evolution

Liu, P., Zhu, J., Zhang, J., Xi, P., Tao, K., Gao, D., & Xue, D. (2017) · ACS Energy Letters · doi:10.1021/acsenergylett.7b00111 · Cited by 377 · see citing works

Dual‐Functional N Dopants in Edges and Basal Plane of MoS 2 Nanosheets Toward Efficient and Durable Hydrogen Evolution

Xiao, W., Liu, P., Zhang, J., Song, W., Feng, Y. P., Gao, D., & Ding, J. (2016) · Advanced Energy Materials · doi:10.1002/aenm.201602086 · Cited by 368 · see citing works

Transition Metal‐Promoted V2CO2 (MXenes): A New and Highly Active Catalyst for Hydrogen Evolution Reaction

Ling, C., Shi, L., Ouyang, Y., Chen, Q., & Wang, J. (2016) · Advanced Science · doi:10.1002/advs.201600180 · Cited by 365 · see citing works

Charge Mediated Semiconducting-to-Metallic Phase Transition in Molybdenum Disulfide Monolayer and Hydrogen Evolution Reaction in New 1T′ Phase

Gao, G., Jiao, Y., Ma, F., Jiao, Y., Waclawik, E. R., & Du, A. (2015) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.5b04658 · Cited by 362 · see citing works

2D/2D Heterojunctions for Catalysis

Su, J., Li, G., Li, X., & Chen, J. (2019) · Advanced Science · doi:10.1002/advs.201801702 · Cited by 351 · see citing works

Ultrathin MXene nanosheets with rich fluorine termination groups realizing efficient electrocatalytic hydrogen evolution

Li, S., Tuo, P., Xie, J., Zhang, X., Xu, J., Bao, J., Pan, B., & Xie, Y. (2018) · Nano Energy · doi:10.1016/j.nanoen.2018.03.022 · Cited by 343 · see citing works

Engineered 2D Transition Metal Dichalcogenides—A Vision of Viable Hydrogen Evolution Reaction Catalysis

Lin, L., Sherrell, P. C., Liu, Y., Lei, W., Zhang, S., Zhang, H., Wallace, G. G., & Chen, J. (2020) · Advanced Energy Materials · doi:10.1002/aenm.201903870 · Cited by 335 · see citing works

Engineering stepped edge surface structures of MoS ₂ sheet stacks to accelerate the hydrogen evolution reaction

Hu, J., Huang, B., Zhang, C., Wang, Z., An, Y., Zhou, D., Lin, H., Leung, M. K. H., & Yang, S. (2017) · Energy & Environmental Science · doi:10.1039/c6ee03629e · Cited by 334 · see citing works

Understanding catalysis in a multiphasic two-dimensional transition metal dichalcogenide

Chou, S. S., Sai, N., Lu, P., Coker, E. N., Liu, S., Artyushkova, K., Luk, T. S., Kaehr, B., & Brinker, C. J. (2015) · Nature Communications · doi:10.1038/ncomms9311 · Cited by 332 · see citing works

Unveiling Active Sites for the Hydrogen Evolution Reaction on Monolayer MoS 2

Zhang, J., Wu, J., Guo, H., Chen, W., Yuan, J., Martinez, U., Gupta, G., Mohite, A. D., Ajayan, P. M., & Lou, J. (2017) · Advanced Materials · doi:10.1002/adma.201701955 · Cited by 320 · see citing works

Ampere-hour-scale zinc–air pouch cells

Shinde, S. S., Jung, J. Y., Wagh, N. K., Lee, C. H., Kim, D., Kim, S., Lee, S. U., & Lee, J. (2021) · Nature Energy · doi:10.1038/s41560-021-00807-8 · Cited by 316 · see citing works

TMD-based highly efficient electrocatalysts developed by combined computational and experimental approaches

Zhu, C., Gao, D., Ding, J., Chao, D., & Wang, J. (2018) · Chemical Society Reviews · doi:10.1039/c7cs00705a · Cited by 314 · see citing works

How Doped MoS 2 Breaks Transition-Metal Scaling Relations for CO 2 Electrochemical Reduction

Hong, X., Chan, K., Tsai, C., & Nørskov, J. K. (2016) · ACS Catalysis · doi:10.1021/acscatal.6b00619 · Cited by 313 · see citing works

Molybdenum Sulfides and Selenides as Possible Electrocatalysts for CO ₂ Reduction

Chan, K., Tsai, C., Hansen, H. A., & Nørskov, J. K. (2014) · ChemCatChem · doi:10.1002/cctc.201402128 · Cited by 311 · see citing works

Regulation of Coordination Number over Single Co Sites: Triggering the Efficient Electroreduction of CO 2

Wang, X., Chen, Z., Zhao, X., Yao, T., Chen, W., You, R., Zhao, C., Wu, G., Wang, J., Huang, W., et al. (2017) · Angewandte Chemie · doi:10.1002/ange.201712451 · Cited by 310 · see citing works

Spontaneous full photocatalytic water splitting on 2D MoSe 2 /SnSe 2 and WSe 2 /SnSe 2 vdW heterostructures

Fan, Y., Wang, J., & Zhao, M. (2019) · Nanoscale · doi:10.1039/c9nr03469b · Cited by 307 · see citing works

Two-dimensional transition metal dichalcogenides in supercapacitors and secondary batteries

Lin, L., Lei, W., Zhang, S., Liu, Y., Wallace, G. G., & Chen, J. (2019) · Energy storage materials · doi:10.1016/j.ensm.2019.02.023 · Cited by 292 · see citing works

Emerging energy applications of two-dimensional layered transition metal dichalcogenides

Li, H., Shi, Y., Chiu, M., & Li, L. (2015) · Nano Energy · doi:10.1016/j.nanoen.2015.10.023 · Cited by 290 · see citing works

Hierarchical spheres constructed by defect-rich MoS2/carbon nanosheets for efficient electrocatalytic hydrogen evolution

Yang, L., Zhou, W., Lu, J., Hou, D., Ke, Y., Li, G., Tang, Z., Kang, X., & Chen, S. (2016) · Nano Energy · doi:10.1016/j.nanoen.2016.02.056 · Cited by 288 · see citing works

Achieving Efficient Incorporation of π‐Electrons into Graphitic Carbon Nitride for Markedly Improved Hydrogen Generation

Li, J., Wu, D., Iocozzia, J., Du, H., Liu, X., Yuan, Y., Zhou, W., Li, Z., Xue, Z., & Lin, Z. (2018) · Angewandte Chemie International Edition · doi:10.1002/anie.201813117 · Cited by 285 · see citing works

Engineering MoS2 nanomesh with holes and lattice defects for highly active hydrogen evolution reaction

Li, Y., Yin, K., Wang, L., Lu, X., Zhang, Y., Liu, Y., Yan, D., Song, Y., & Luo, S. (2018) · Applied Catalysis B: Environmental · doi:10.1016/j.apcatb.2018.05.080 · Cited by 283 · see citing works

Drastic Layer‐Number‐Dependent Activity Enhancement in Photocatalytic H₂ Evolution over <i>n</i>MoS₂/CdS (<i>n</i> ≥ 1) Under Visible Light

Chang, K., Li, M., Wang, T., Ouyang, S., Li, P., Liu, L., & Ye, J. (2015) · Advanced Energy Materials · doi:10.1002/aenm.201402279 · Cited by 276 · see citing works

Design of active nickel single-atom decorated MoS2 as a pH-universal catalyst for hydrogen evolution reaction

Wang, Q., Zhao, Z. L., Dong, S., He, D., Lawrence, M. J., Han, S., Cai, C., Xiang, S., Rodriguez, P., Xiang, B., et al. (2018) · Nano Energy · doi:10.1016/j.nanoen.2018.09.003 · Cited by 273 · see citing works

Enabling Colloidal Synthesis of Edge-Oriented MoS 2 with Expanded Interlayer Spacing for Enhanced HER Catalysis

Sun, Y., Alimohammadi, F., Zhang, D., & Guo, G. (2017) · Nano Letters · doi:10.1021/acs.nanolett.6b05346 · Cited by 270 · see citing works

Layered Intercalation Materials

Zhou, J., Lin, Z., Ren, H., Duan, X., Shakir, I., Huang, Y., & Duan, X. (2021) · Advanced Materials · doi:10.1002/adma.202004557 · Cited by 269 · see citing works

Advances and Challenges for the Electrochemical Reduction of CO 2 to CO: From Fundamentals to Industrialization

Jin, S., Hao, Z., Zhang, K., Yan, Z., & Chen, J. (2021) · Angewandte Chemie · doi:10.1002/ange.202101818 · Cited by 268 · see citing works

Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites

Wang, Z., Li, Q., Xu, H., Dahl‐Petersen, C., Yang, Q., Cheng, D., Cao, D., Besenbacher, F., Lauritsen, J. V., Helveg, S., et al. (2018) · Nano Energy · doi:10.1016/j.nanoen.2018.04.067 · Cited by 259 · see citing works

RhSe2: A Superior 3D Electrocatalyst with Multiple Active Facets for Hydrogen Evolution Reaction in Both Acid and Alkaline Solutions

Zhong, W., Xiao, B., Lin, Z., Wang, Z., Huang, L., Shen, S., Zhang, Q., & Gu, L. (2021) · Advanced Materials · doi:10.1002/adma.202007894 · Cited by 258 · see citing works

Optimization of active surface area of flower like MoS2 using V-doping towards enhanced hydrogen evolution reaction in acidic and basic medium

Bolar, S., Shit, S., Kumar, J. S., Murmu, N. C., Ramaraj, S. G., Inokawa, H., & Kuila, T. (2019) · Applied Catalysis B: Environmental · doi:10.1016/j.apcatb.2019.04.028 · Cited by 255 · see citing works

Electronic structure engineering on two-dimensional (2D) electrocatalytic materials for oxygen reduction, oxygen evolution, and hydrogen evolution reactions

Chandrasekaran, S., Ma, D., Ge, Y., Deng, L., Bowen, C., Roscow, J. I., Zhang, Y., Lin, Z., Misra, R. D. K., Li, J., et al. (2020) · Nano Energy · doi:10.1016/j.nanoen.2020.105080 · Cited by 251 · see citing works

Molybdenum carbide stabilized on graphene with high electrocatalytic activity for hydrogen evolution reaction

Pan, L., Li, Y., Yang, S., Liu, P. F., Yu, M., & Yang, H. G. (2014) · Chemical Communications · doi:10.1039/c4cc05698a · Cited by 244 · see citing works

Boosting electrochemical water splitting via ternary NiMoCo hybrid nanowire arrays

Hu, K., Wu, M., Hinokuma, S., Ohto, T., Wakisaka, M., Fujita, J., & Ito, Y. (2019) · Journal of Materials Chemistry A · doi:10.1039/c8ta11250a · Cited by 239 · see citing works

Monolayer-Precision Synthesis of Molybdenum Sulfide Nanoparticles and Their Nanoscale Size Effects in the Hydrogen Evolution Reaction

Seo, B., Jung, G. Y., Jin, Y., Jeong, H. Y., Cheon, J. Y., Lee, J. H., Kim, H. Y., Kim, J. C., Shin, H. S., Kwak, S. K., et al. (2015) · ACS Nano · doi:10.1021/acsnano.5b00786 · Cited by 229 · see citing works

Recent advances in emerging single atom confined two-dimensional materials for water splitting applications

Alarawi, A., Ramalingam, V., & He, J. (2018) · Materials Today Energy · doi:10.1016/j.mtener.2018.10.014 · Cited by 229 · see citing works

PtSe2/Pt Heterointerface with Reduced Coordination for Boosted Hydrogen Evolution Reaction

Wang, Z., Xiao, B., Lin, Z., Xu, Y., Lin, Y., Meng, F., Zhang, Q., Gu, L., Fang, B., Guo, S., et al. (2021) · Angewandte Chemie International Edition · doi:10.1002/anie.202110335 · Cited by 229 · see citing works

Mutually beneficial Co 3 O 4 @MoS 2 heterostructures as a highly efficient bifunctional catalyst for electrochemical overall water splitting

Liu, J., Wang, J., Zhang, B., Ruan, Y., Wan, H., Ji, X. Y., Xu, K., Zha, D., Miao, L., & Jiang, J. (2017) · Journal of Materials Chemistry A · doi:10.1039/c7ta10048e · Cited by 224 · see citing works

Transition metal atom doping of the basal plane of MoS 2 monolayer nanosheets for electrochemical hydrogen evolution

Lau, T. H. M., Lu, X., Kulhavý, J., Wu, S., Lu, L., Wu, T., Kato, R., Foord, J. S., Soo, Y. L., Suenaga, K., et al. (2018) · Chemical Science · doi:10.1039/c8sc01114a · Cited by 221 · see citing works

Increasing the active sites and intrinsic activity of transition metal chalcogenide electrocatalysts for enhanced water splitting

Huang, J., Jiang, Y. L., An, T., & Cao, M. (2020) · Journal of Materials Chemistry A · doi:10.1039/d0ta08802a · Cited by 221 · see citing works

3D Mesoporous van der Waals Heterostructures for Trifunctional Energy Electrocatalysis

Tang, C., Zhong, L., Zhang, B., Wang, H., & Zhang, Q. (2018) · Advanced Materials · doi:10.1002/adma.201705110 · Cited by 218 · see citing works

Advancement of Platinum (Pt)-Free (Non-Pt Precious Metals) and/or Metal-Free (Non-Precious-Metals) Electrocatalysts in Energy Applications: A Review and Perspectives

Bhatt, M. D., & Lee, J. Y. (2020) · Energy & Fuels · doi:10.1021/acs.energyfuels.0c00953 · Cited by 215 · see citing works

Magnetic Enhancement for Hydrogen Evolution Reaction on Ferromagnetic MoS 2 Catalyst

Zhou, W., Chen, M., Guo, M., Hong, A., Yu, T., Luo, X., Yuan, C., Lei, W., & Wang, S. (2020) · Nano Letters · doi:10.1021/acs.nanolett.0c00845 · Cited by 212 · see citing works

Efficient hydrogen evolution in transition metal dichalcogenides via a simple one-step hydrazine reaction

Cummins, D., Martinez, U., Sherehiy, A., Kappera, R., Martinez‐Garcia, A., Schulze, R. K., Jasinski, J. B., Zhang, J., Gupta, R. K., Lou, J., et al. (2016) · Nature Communications · doi:10.1038/ncomms11857 · Cited by 211 · see citing works

Transition metal-based electrocatalysts for overall water splitting

Li, X., Huang, C., Han, W., Ouyang, T., & Liu, Z. (2021) · Chinese Chemical Letters · doi:10.1016/j.cclet.2021.01.047 · Cited by 211 · see citing works

Biomolecule-assisted self-assembly of CdS/MoS2/graphene hollow spheres as high-efficiency photocatalysts for hydrogen evolution without noble metals

Yu, X., Du, R., Li, B., Zhang, Y., Liu, H., Qu, J., & An, X. (2015) · Applied Catalysis B: Environmental · doi:10.1016/j.apcatb.2015.09.003 · Cited by 208 · see citing works

Enhanced Hydrogen Evolution Activity on the Edge of MoS 2 through W Substitution

Wang, H., & Gao, L. (2018) · ECS Meeting Abstracts · doi:10.1149/ma2018-02/54/1903 · Cited by 1 · see citing works

Activation of MoS2 interfacial S sites for hydrogen evolution by synergistic effects of electron traversing effect and S-vacancy

Luo, H., Zhang, X., Qu, F., Zhang, K., Zhu, M., Cai, J., Xu, K., Yu, S., & Guo, D. (2024) · International Journal of Hydrogen Energy · doi:10.1016/j.ijhydene.2025.01.336 · Cited by 3 · see citing works

Role of the Edge Properties in the Hydrogen Evolution Reaction on MoS2

Lazar, P., & Otyepka, M. (2017) · Chemistry - A European Journal · doi:10.1002/chem.201605848 · Cited by 39 · see citing works

Hydrogen evolution on nano-particulate transition metal sulfides

Bonde, J., Moses, P. G., Jaramillo, T. F., Nørskov, J. K., & Chorkendorff, I. (2008) · Faraday Discussions · doi:10.1039/b803857k · Cited by 805 · see citing works

Hydrogen evolution reaction mechanism on 2H-MoS2 electrocatalyst

Li, W., Liu, G., Li, J., Wang, Y., Ricardez‐Sandoval, L., Zhang, Y., & Zhang, Z. (2019) · Applied Surface Science · doi:10.1016/j.apsusc.2019.143869 · Cited by 105 · see citing works