MoS2-OH Bilayer-Mediated Growth of Inch-Sized Monolayer MoS2 on Arbitrary Substrates.

Due to remarkable electronic property, optical transparency, and mechanical flexibility, monolayer molybdenum disulfide (MoS2) has been demonstrated to be promising for electronic and optoelectronic devices. To date, the growth of high-quality and large-scale monolayer MoS2 has been one of the main challenges for practical applications. Here we present a MoS2-OH bilayer-mediated method that can fabricate inch-sized monolayer MoS2 on arbitrary substrates. This approach relies on a layer of hydroxide groups (-OH) that are preferentially attached to the (001) surface of MoS2 to form a MoS2-OH bilayer structure for growth of large-area monolayer MoS2 during the growth process. Specifically, the hydroxide layer impedes vertical growth of MoS2 layers along the [001] zone axis, promoting the monolayer growth of MoS2, constrains growth of the MoS2 monolayer only in the lateral direction into larger area, and effectively reduces sulfur vacancies and defects according to density functional theory calculations. Finally, the hydroxide groups advantageously prevent the MoS2 from interface oxidation in air, rendering high-quality MoS2 monolayers with carrier mobility up to ∼30 cm2 V-1 s-1. Using this approach, inch-sized uniform monolayer MoS2 has been fabricated on the sapphire and mica and high-quality monolayer MoS2 of single-crystalline domains exceeding 200 μm has been grown on various substrates including amorphous SiO2 and quartz and crystalline Si, SiC, Si3N4, and graphene This method provides a new opportunity for the monolayer growth of other two-dimensional transition metal dichalcogenides such as WS2 and MoSe2.

[1]  Q. Fu,et al.  Repeated growth and bubbling transfer of graphene with millimetre-size single-crystal grains using platinum , 2012, Nature Communications.

[2]  C. Lenardi,et al.  XPS investigation of preferential sputtering of S from MoS2 and determination of MoSx stoichiometry from Mo and S peak positions , 1999 .

[3]  P. Ajayan,et al.  Synthesis of Millimeter‐Scale Transition Metal Dichalcogenides Single Crystals , 2016 .

[4]  Shanshan Yao,et al.  Surface-energy-assisted perfect transfer of centimeter-scale monolayer and few-layer MoS₂ films onto arbitrary substrates. , 2014, ACS nano.

[5]  Lain‐Jong Li,et al.  Synthesis of Large‐Area MoS2 Atomic Layers with Chemical Vapor Deposition , 2012, Advanced materials.

[6]  P. Marcus,et al.  Li-Ion Intercalation in Thermal Oxide Thin Films of MoO3 as Studied by XPS, RBS, and NRA , 2008 .

[7]  J. Appenzeller,et al.  High performance multilayer MoS2 transistors with scandium contacts. , 2013, Nano letters.

[8]  Guosong Hong,et al.  MoS2 nanoparticles grown on graphene: an advanced catalyst for the hydrogen evolution reaction. , 2011, Journal of the American Chemical Society.

[9]  E. Mccafferty,et al.  Determination of the concentration of surface hydroxyl groups on metal oxide films by a quantitative XPS method , 1998 .

[10]  Zhongfan Liu,et al.  Batch production of 6-inch uniform monolayer molybdenum disulfide catalyzed by sodium in glass , 2018, Nature Communications.

[11]  Jing Zhao,et al.  Oxygen-Assisted Chemical Vapor Deposition Growth of Large Single-Crystal and High-Quality Monolayer MoS2. , 2015, Journal of the American Chemical Society.

[12]  Kresse,et al.  Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set. , 1996, Physical review. B, Condensed matter.

[13]  Madan Dubey,et al.  Two-dimensional material nanophotonics , 2014, 1410.3882.

[14]  Deji Akinwande,et al.  Two-dimensional flexible nanoelectronics , 2014, Nature Communications.

[15]  Yi Liu,et al.  Controlled Scalable Synthesis of Uniform, High-Quality Monolayer and Few-layer MoS2 Films , 2013, Scientific Reports.

[16]  M. Bocquet,et al.  Chemisorption of Hydroxide on 2D Materials from DFT Calculations: Graphene versus Hexagonal Boron Nitride. , 2016, The journal of physical chemistry letters.

[17]  Qing Hua Wang,et al.  Electronics and optoelectronics of two-dimensional transition metal dichalcogenides. , 2012, Nature nanotechnology.

[18]  Wei Liu,et al.  High Detectivity and Transparent Few‐Layer MoS2/Glassy‐Graphene Heterostructure Photodetectors , 2018, Advanced materials.

[19]  Hua Zhang,et al.  Single-layer MoS2 phototransistors. , 2012, ACS nano.

[20]  Liying Jiao,et al.  Controlled synthesis of highly crystalline MoS2 flakes by chemical vapor deposition. , 2013, Journal of the American Chemical Society.

[21]  Lianmao Peng,et al.  Large-area synthesis of high-quality and uniform monolayer WS2 on reusable Au foils , 2015, Nature Communications.

[22]  Woong-Ki Hong,et al.  Electric stress-induced threshold voltage instability of multilayer MoS2 field effect transistors. , 2013, ACS nano.

[23]  Horacio D Espinosa,et al.  Pushing the envelope of in situ transmission electron microscopy. , 2015, ACS nano.

[24]  Junsong Yuan,et al.  Exploring atomic defects in molybdenum disulphide monolayers , 2015, Nature Communications.

[25]  Yu-Chuan Lin,et al.  Growth of large-area and highly crystalline MoS2 thin layers on insulating substrates. , 2012, Nano letters.

[26]  Stefan Grimme,et al.  Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction , 2006, J. Comput. Chem..

[27]  S. Louie,et al.  Evolution of interlayer coupling in twisted molybdenum disulfide bilayers , 2014, Nature Communications.

[28]  Zhongfan Liu,et al.  Substrate Facet Effect on the Growth of Monolayer MoS2 on Au Foils. , 2015, ACS nano.

[29]  Hyochul Kim,et al.  Large Work Function Modulation of Monolayer MoS2 by Ambient Gases. , 2016, ACS nano.

[30]  Satoshi Takeda,et al.  Surface OH group governing adsorption properties of metal oxide films , 1999 .

[31]  Jun Lou,et al.  Vapour phase growth and grain boundary structure of molybdenum disulphide atomic layers. , 2013, Nature materials.

[32]  Burke,et al.  Generalized Gradient Approximation Made Simple. , 1996, Physical review letters.

[33]  Hugen Yan,et al.  Anomalous lattice vibrations of single- and few-layer MoS2. , 2010, ACS nano.

[34]  Wei Liu,et al.  Chemical Vapor Deposition of Large-Size Monolayer MoSe2 Crystals on Molten Glass. , 2017, Journal of the American Chemical Society.

[35]  Hua Zhang,et al.  The chemistry of two-dimensional layered transition metal dichalcogenide nanosheets. , 2013, Nature chemistry.

[36]  Y. Chai,et al.  Direct TEM observations of growth mechanisms of two-dimensional MoS2 flakes , 2016, Nature Communications.

[37]  P. Ajayan,et al.  Large Area Vapor Phase Growth and Characterization of MoS2 Atomic Layers on SiO2 Substrate , 2011, 1111.5072.

[38]  J. Nørskov,et al.  The stability of the hydroxylated (0001) surface of alpha-Al2O3 , 2003 .

[39]  H. A. Therese,et al.  In Situ Heating TEM Study of Onion-like WS2 and MoS2 Nanostructures Obtained via MOCVD , 2008 .

[40]  Jun Luo,et al.  Robust epitaxial growth of two-dimensional heterostructures, multiheterostructures, and superlattices , 2017, Science.

[41]  Lain-Jong Li,et al.  Recent advances in controlled synthesis of two-dimensional transition metal dichalcogenides via vapour deposition techniques. , 2015, Chemical Society reviews.

[42]  H. Chan,et al.  Direct observation of carbon nanostructure growth at liquid-solid interfaces. , 2014, Chemical communications.

[43]  J. Maultzsch,et al.  Effect of contaminations and surface preparation on the work function of single layer MoS2 , 2014, Beilstein journal of nanotechnology.

[44]  Hua Zhang,et al.  Two-Dimensional Metal Nanomaterials: Synthesis, Properties, and Applications. , 2018, Chemical reviews.

[45]  G. Kresse,et al.  From ultrasoft pseudopotentials to the projector augmented-wave method , 1999 .

[46]  Blöchl,et al.  Projector augmented-wave method. , 1994, Physical review. B, Condensed matter.

[47]  Zhiyong Xiao,et al.  A Facile Space-Confined Solid-Phase Sulfurization Strategy for Growth of High-Quality Ultrathin Molybdenum Disulfide Single Crystals. , 2018, Nano letters.

[48]  P. Avouris,et al.  Electroluminescence in single layer MoS2. , 2012, Nano letters.

[49]  Xinran Wang,et al.  Electrical characterization of back-gated bi-layer MoS2 field-effect transistors and the effect of ambient on their performances , 2012 .