Structural Studies of Alloyed and Nanoparticle Transition Metal Dichalcogenides by Selenium-77 Solid-State Nuclear Magnetic Resonance Spectroscopy

Carnahan, Scott L.; Gi, Eunbyeol; Wagner, Molly; Santhiran, Anuluxan; Amerongen, Elise; Yin, Hang; Geisenhoff, Jessica Q.; Rahman, Sharifur; Dolotko, Oleksandr; Hlova, Ihor Z.; Balema, Viktor P.; Smith, Emily A.; Schimpf, Alina M.; Vela, Javier; Rossini, Aaron J.

doi:10.1021/acs.chemmater.4c02352

Title: Structural Studies of Alloyed and Nanoparticle Transition Metal Dichalcogenides by Selenium-77 Solid-State Nuclear Magnetic Resonance Spectroscopy

Journal Article · 13 November 2024 · Chemistry of Materials

DOI: https://doi.org/10.1021/acs.chemmater.4c02352 · OSTI ID:2477808

^[1];

^[2]; Wagner, Molly ^[3]; Santhiran, Anuluxan ^[2]; Amerongen, Elise ^[4]; Yin, Hang ^[5]; Geisenhoff, Jessica Q. ^[5];

^[2]; Dolotko, Oleksandr ^[3];

^[3]; Balema, Viktor P. ^[6];

^[2];

^[5];

^[2];

^[2]

Ames Lab., and Iowa State Univ., Ames, IA (United States); St. Mary's Univ. of Minnesota, Winona, MN (United States)
Ames Lab., and Iowa State Univ., Ames, IA (United States)
Ames Laboratory (AMES), Ames, IA (United States)
Ames Laboratory (AMES), Ames, IA (United States); St. Mary's Univ. of Minnesota, Winona, MN (United States)
Univ. of California, San Diego, CA (United States)
Ames Laboratory (AMES), Ames, IA (United States); Clemson Univ., SC (United States); ChemImpakt LLC, Milwaukee, WI (United States)

Layered transition metal dichalcogenides (TMDCs) such as MoS₂, MoSe₂, and WSe₂ are under intense investigation because they are atomically thin semiconductors with photophysical properties that can be tuned by changing their composition or morphology. Mechanochemical processing has been proposed as a method to obtain alloyed TMDCs in the series Mo_1–xW_xS_ySe_2–y (x = 0–1; y = 0–2). However, elucidating the chemical transformations occurring at the atomic scale following mechanochemical processing can be challenging because the products are often amorphous or microcrystalline. To address this challenge, we probe TMDC mixing and alloying by using a combination of powder X-ray diffraction, Raman spectroscopy, diffuse reflectance spectroscopy, ⁷⁷Se solid-state nuclear magnetic resonance (SSNMR) spectroscopy, and planewave density functional theory (DFT) calculations. The nature of the milling material and reaction atmosphere are shown to be essential factors in limiting the formation of undesired oxide byproducts. We demonstrate acquisition of ⁷⁷Se SSNMR spectra using different combinations of Carr-Purcell Meiboom-Gill acquisition (CPMG) pulse sequences, magic angle spinning (MAS), and MAS dynamic nuclear polarization. Further, the combination of SSNMR with the other characterization methods clearly demonstrates that high energy impact ball milling induces molecular level alloying of Mo, W and chalcogen atoms in the family Mo_1–xW_xS_ySe_2–y. Gauge including projector augmented wave DFT calculations yield accurate ⁷⁷Se chemical shift (CS) tensor components. ⁷⁷Se SSNMR spectroscopy was also applied to study the structure of WSe₂ nanocrystals intercalated with ethylenediamine. The intercalated WSe₂ nanocrystals exhibit a more positive isotropic ⁷⁷Se CS as compared to bulk WSe₂, however, the ⁷⁷Se CS anisotropy is the same, confirming the WSe₂ layers have a similar structure as in their bulk counterparts.

View Accepted Manuscript (DOE)

Cite

Export

Save

Research Organization:: Ames Laboratory (AMES), Ames, IA (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: AC02-07CH11358

OSTI ID:: 2477808

Report Number(s):: AL-J--660

Journal Information:: Chemistry of Materials, Journal Name: Chemistry of Materials Journal Issue: 22 Vol. 36; ISSN 0897-4756

Publisher:: American Chemical Society (ACS)Copyright Statement

Country of Publication:: United States

Language:: English

References (86)

Defect-Rich MoS ₂ Ultrathin Nanosheets with Additional Active Edge Sites for Enhanced Electrocatalytic Hydrogen Evolution Xie, Junfeng; Zhang, Hao; Li, Shuang Advanced Materials, Vol. 25, Issue 40 https://doi.org/10.1002/adma.201302685	journal	August 2013
Thermally Induced 2D Alloy-Heterostructure Transformation in Quaternary Alloys Susarla, Sandhya; Hachtel, Jordan A.; Yang, Xiting Advanced Materials, Vol. 30, Issue 45 https://doi.org/10.1002/adma.201804218	journal	September 2018
Opportunities and Challenges in Applying Solid‐State NMR Spectroscopy in Organic Mechanochemistry Silva, Igor d'Anciães Almeida; Bartalucci, Ettore; Bolm, Carsten Advanced Materials, Vol. 35, Issue 52 https://doi.org/10.1002/adma.202304092	journal	November 2023
Two-Dimensional Semiconductors: From Materials Preparation to Electronic Applications Liu, Bilu; Abbas, Ahmad; Zhou, Chongwu Advanced Electronic Materials, Vol. 3, Issue 7 https://doi.org/10.1002/aelm.201700045	journal	April 2017
Structure of Amorphous Selenium by 2D ⁷⁷ Se NMR Spectroscopy: An End to the Dilemma of Chain versus Ring Marple, Maxwell; Badger, Jackson; Hung, Ivan Angewandte Chemie International Edition, Vol. 56, Issue 33 https://doi.org/10.1002/anie.201704323	journal	August 2017
Electronic Properties of Bulk and Monolayer TMDs: Theoretical Study Within DFT Framework (GVJ-2e Method) Gusakova, Julia; Wang, Xingli; Shiau, Li Lynn physica status solidi (a), Vol. 214, Issue 12 https://doi.org/10.1002/pssa.201700218	journal	September 2017
Evaluation of the Tauc method for optical absorption edge determination: ZnO thin films as a model system: Tauc method for optical absorption edge determination Viezbicke, Brian D.; Patel, Shane; Davis, Benjamin E. physica status solidi (b), Vol. 252, Issue 8 https://doi.org/10.1002/pssb.201552007	journal	March 2015
An Improved Broadband Decoupling Sequence for Liquid Crystals and Solids Fung, B. M.; Khitrin, A. K.; Ermolaev, Konstantin Journal of Magnetic Resonance, Vol. 142, Issue 1 https://doi.org/10.1006/jmre.1999.1896	journal	January 2000
Two Cation Disulfide Layers in the WxMo(1−x)S2 Lamellar Solid Solution Thomazeau, Cécile; Geantet, Christophe; Lacroix, Michel Journal of Solid State Chemistry, Vol. 160, Issue 1 https://doi.org/10.1006/jssc.2001.9208	journal	August 2001
Scanning Electron Microscopy and X-ray Microanalysis Goldstein, Joseph I.; Newbury, Dale E.; Echlin, Patrick https://doi.org/10.1007/978-1-4615-0215-9	book	January 2003
Two-Dimensional Transition-Metal Dichalcogenides Kolobov, Alexander V.; Tominaga, Junji Springer Series in Materials Science https://doi.org/10.1007/978-3-319-31450-1	book	January 2016
Optothermal and electrical properties of ultrathin alloys of mixed dichalcogenides Jenjeti, Ramesh Naidu; Kumar, Rajat; Vankayala, Kiran Journal of Materials Science, Vol. 57, Issue 30 https://doi.org/10.1007/s10853-022-07309-2	journal	July 2022
Mechanical alloying and milling Suryanarayana, C. Progress in Materials Science, Vol. 46, Issue 1-2, p. 1-184 https://doi.org/10.1016/S0079-6425(99)00010-9	journal	January 2001
A two-dimensional MoS2/WSe2 van der Waals heterostructure for enhanced photoelectric performance Si, Keyu; Ma, Jingyao; Lu, Chunhui Applied Surface Science, Vol. 507 https://doi.org/10.1016/j.apsusc.2019.145082	journal	March 2020
Universal Scherrer equation for graphene fragments Lim, Daniel J.; Marks, Nigel A.; Rowles, Matthew R. Carbon, Vol. 162 https://doi.org/10.1016/j.carbon.2020.02.064	journal	June 2020
QCPMG using adiabatic pulses for faster acquisition of ultra-wideline NMR spectra O’Dell, Luke A.; Schurko, Robert W. Chemical Physics Letters, Vol. 464, Issue 1-3 https://doi.org/10.1016/j.cplett.2008.08.095	journal	October 2008
Acquisition of ultra-wideline NMR spectra from quadrupolar nuclei by frequency stepped WURST–QCPMG O’Dell, Luke A.; Rossini, Aaron J.; Schurko, Robert W. Chemical Physics Letters, Vol. 468, Issue 4-6 https://doi.org/10.1016/j.cplett.2008.12.044	journal	January 2009
Raman study of 2H-Mo1−xWxS2 layered mixed crystals Dumcenco, D. O.; Chen, K. Y.; Wang, Y. P. Journal of Alloys and Compounds, Vol. 506, Issue 2 https://doi.org/10.1016/j.jallcom.2010.07.120	journal	September 2010
Testing the sensitivity limits of 33S NMR: An ultra-wideline study of elemental sulfur O’Dell, Luke A.; Moudrakovski, Igor L. Journal of Magnetic Resonance, Vol. 207, Issue 2 https://doi.org/10.1016/j.jmr.2010.08.022	journal	December 2010
Maximizing nuclear hyperpolarization in pulse cooling under MAS Björgvinsdóttir, Snædís; Walder, Brennan J.; Matthey, Nicolas Journal of Magnetic Resonance, Vol. 300 https://doi.org/10.1016/j.jmr.2019.01.011	journal	March 2019
Synthesis and mixing of complex halide perovskites by solvent-free solid-state methods Rosales, Bryan A.; Wei, Lin; Vela, Javier Journal of Solid State Chemistry, Vol. 271 https://doi.org/10.1016/j.jssc.2018.12.054	journal	March 2019
Recent development of two-dimensional transition metal dichalcogenides and their applications Choi, Wonbong; Choudhary, Nitin; Han, Gang Hee Materials Today, Vol. 20, Issue 3 https://doi.org/10.1016/j.mattod.2016.10.002	journal	April 2017
Solid-state selenium-77 NMR Demko, Bryan A.; Wasylishen, Roderick E. Progress in Nuclear Magnetic Resonance Spectroscopy, Vol. 54, Issue 3-4 https://doi.org/10.1016/j.pnmrs.2008.10.002	journal	April 2009
Dynamic nuclear polarization for sensitivity enhancement in modern solid-state NMR Lilly Thankamony, Aany Sofia; Wittmann, Johannes J.; Kaushik, Monu Progress in Nuclear Magnetic Resonance Spectroscopy, Vol. 102-103 https://doi.org/10.1016/j.pnmrs.2017.06.002	journal	November 2017
A natural abundance 77Se solid-state NMR study of inorganic compounds Kemp, T. F.; Wong, A.; Smith, M. E. Solid State Nuclear Magnetic Resonance, Vol. 34, Issue 4 https://doi.org/10.1016/j.ssnmr.2008.10.003	journal	November 2008
The WURST kind of pulses in solid-state NMR O'Dell, Luke A. Solid State Nuclear Magnetic Resonance, Vol. 55-56 https://doi.org/10.1016/j.ssnmr.2013.10.003	journal	October 2013
In-situ reaction monitoring of a mechanochemical ball mill reaction with solid state NMR Schiffmann, Jan Gerrit; Emmerling, Franziska; Martins, Inês C. B. Solid State Nuclear Magnetic Resonance, Vol. 109 https://doi.org/10.1016/j.ssnmr.2020.101687	journal	October 2020
Manipulation of Precursor Reactivity for the Facile Synthesis of Heterostructured and Hollow Metal Selenide Nanocrystals Geisenhoff, Jessica Q.; Tamura, Ashley K.; Schimpf, Alina M. Chemistry of Materials, Vol. 32, Issue 6 https://doi.org/10.1021/acs.chemmater.9b04305	journal	February 2020
Chemical Vapor Deposition Growth and Applications of Two-Dimensional Materials and Their Heterostructures Cai, Zhengyang; Liu, Bilu; Zou, Xiaolong Chemical Reviews, Vol. 118, Issue 13 https://doi.org/10.1021/acs.chemrev.7b00536	journal	January 2018
Formation of Stable Radicals by Mechanochemistry and Their Application for Magic Angle Spinning Dynamic Nuclear Polarization Solid-State NMR Spectroscopy Carnahan, Scott L.; Riemersma, Kipper; Hlova, Ihor Z. The Journal of Physical Chemistry A, Vol. 128, Issue 18 https://doi.org/10.1021/acs.jpca.4c00228	journal	April 2024
Sensitivity Enhancements in Lithium Titanates by Incipient Wetness Impregnation DNP NMR Björgvinsdóttir, Snædís; Moutzouri, Pinelopi; Berruyer, Pierrick The Journal of Physical Chemistry C, Vol. 124, Issue 30 https://doi.org/10.1021/acs.jpcc.0c05105	journal	July 2020
Exciting Opportunities for Solid-State ⁹⁵Mo NMR Studies of MoS₂ Nanostructures in Materials Research from a Low to an Ultrahigh Magnetic Field (35.2 T) Jakobsen, Hans J.; Bildsøe, Henrik; Bondesgaard, Martin The Journal of Physical Chemistry C, Vol. 125, Issue 14 https://doi.org/10.1021/acs.jpcc.0c10522	journal	April 2021
Chemical-Induced Slippage in Bulk WSe₂ Gi, Eunbyeol; Chen, Yunhua; Wang, Xuan Robben The Journal of Physical Chemistry Letters, Vol. 13, Issue 47 https://doi.org/10.1021/acs.jpclett.2c02963	journal	November 2022
Materials Characterization by Dynamic Nuclear Polarization-Enhanced Solid-State NMR Spectroscopy Rossini, Aaron J. The Journal of Physical Chemistry Letters, Vol. 9, Issue 17 https://doi.org/10.1021/acs.jpclett.8b01891	journal	August 2018
Tutorial on Powder X-ray Diffraction for Characterizing Nanoscale Materials Holder, Cameron F.; Schaak, Raymond E. ACS Nano, Vol. 13, Issue 7 https://doi.org/10.1021/acsnano.9b05157	journal	July 2019
Dynamic Nuclear Polarization Surface Enhanced NMR Spectroscopy Rossini, Aaron J.; Zagdoun, Alexandre; Lelli, Moreno Accounts of Chemical Research, Vol. 46, Issue 9 https://doi.org/10.1021/ar300322x	journal	March 2013
High Frequency Dynamic Nuclear Polarization Ni, Qing Zhe; Daviso, Eugenio; Can, Thach V. Accounts of Chemical Research, Vol. 46, Issue 9 https://doi.org/10.1021/ar300348n	journal	April 2013
How Robust are Semiconductor Nanorods? Investigating the Stability and Chemical Decomposition Pathways of Photoactive Nanocrystals Reichert, Malinda D.; Lin, Chia-Cheng; Vela, Javier Chemistry of Materials, Vol. 26, Issue 13 https://doi.org/10.1021/cm500896n	journal	June 2014
Detailed photocurrent spectroscopy of the semiconducting group VIB transition metal dichalcogenides Kam, K. K.; Parkinson, B. A. The Journal of Physical Chemistry, Vol. 86, Issue 4 https://doi.org/10.1021/j100393a010	journal	February 1982
NMR Analysis of Surfaces and Interfaces in 2-nm CdSe Berrettini, Mia G.; Braun, Gary; Hu, Jerry G. Journal of the American Chemical Society, Vol. 126, Issue 22 https://doi.org/10.1021/ja037228h	journal	June 2004
Surface Enhanced NMR Spectroscopy by Dynamic Nuclear Polarization Lesage, Anne; Lelli, Moreno; Gajan, David Journal of the American Chemical Society, Vol. 132, Issue 44 https://doi.org/10.1021/ja104771z	journal	November 2010
Large Molecular Weight Nitroxide Biradicals Providing Efficient Dynamic Nuclear Polarization at Temperatures up to 200 K Zagdoun, Alexandre; Casano, Gilles; Ouari, Olivier Journal of the American Chemical Society, Vol. 135, Issue 34 https://doi.org/10.1021/ja405813t	journal	August 2013
Size- and Site-Dependent Reconstruction in CdSe QDs Evidenced by ⁷⁷ Se{ ¹ H} CP-MAS NMR Spectroscopy Lovingood, Derek D.; Achey, Randall; Paravastu, Anant K. Journal of the American Chemical Society, Vol. 132, Issue 10 https://doi.org/10.1021/ja907511r	journal	March 2010
Revealing the Surface Structure of CdSe Nanocrystals by Dynamic Nuclear Polarization-Enhanced ⁷⁷ Se and ¹¹³ Cd Solid-State NMR Spectroscopy Chen, Yunhua; Dorn, Rick W.; Hanrahan, Michael P. Journal of the American Chemical Society, Vol. 143, Issue 23 https://doi.org/10.1021/jacs.1c03162	journal	June 2021
Structure of Colloidal Quantum Dots from Dynamic Nuclear Polarization Surface Enhanced NMR Spectroscopy Piveteau, Laura; Ong, Ta-Chung; Rossini, Aaron J. Journal of the American Chemical Society, Vol. 137, Issue 43 https://doi.org/10.1021/jacs.5b09248	journal	October 2015
Bulk Nuclear Hyperpolarization of Inorganic Solids by Relay from the Surface Björgvinsdóttir, Snædís; Walder, Brennan J.; Pinon, Arthur C. Journal of the American Chemical Society, Vol. 140, Issue 25 https://doi.org/10.1021/jacs.8b03883	journal	May 2018
Probing the Surface Structure of Semiconductor Nanoparticles by DNP SENS with Dielectric Support Materials Hanrahan, Michael P.; Chen, Yunhua; Blome-Fernández, Rafael Journal of the American Chemical Society, Vol. 141, Issue 39 https://doi.org/10.1021/jacs.9b05509	journal	August 2019
⁷⁷ Se Solid-State NMR of Inorganic and Organoselenium Systems: A Combined Experimental and Computational Study Griffin, John M.; Knight, Fergus R.; Hua, Guoxiong The Journal of Physical Chemistry C, Vol. 115, Issue 21 https://doi.org/10.1021/jp202550f	journal	May 2011
Observation of a Continuous Random Network Structure in Ge _x Se _{100– x} Glasses: Results from High-Resolution ⁷⁷ Se MATPASS/CPMG NMR Spectroscopy Kaseman, Derrick C.; Hung, Ivan; Gan, Zhehong The Journal of Physical Chemistry B, Vol. 117, Issue 3 https://doi.org/10.1021/jp311320t	journal	January 2013
Van der Waals heterostructures Geim, A. K.; Grigorieva, I. V. Nature, Vol. 499, Issue 7459, p. 419-425 https://doi.org/10.1038/nature12385	journal	July 2013
Unprecedented generation of 3D heterostructures by mechanochemical disassembly and re-ordering of incommensurate metal chalcogenides Dolotko, Oleksandr; Hlova, Ihor Z.; Pathak, Arjun K. Nature Communications, Vol. 11, Issue 1 https://doi.org/10.1038/s41467-020-16672-0	journal	June 2020
Solid-State 77Se NMR of Organoselenium Compounds through Cross Polarization Magic Angle Spinning (CPMAS) Method Wei, Duo; Han, Mengting; Yu, Lei Scientific Reports, Vol. 7, Issue 1 https://doi.org/10.1038/s41598-017-06892-8	journal	July 2017
Lattice strain effects on the optical properties of MoS2 nanosheets Yang, Lei; Cui, Xudong; Zhang, Jingyu Scientific Reports, Vol. 4, Issue 1 https://doi.org/10.1038/srep05649	journal	July 2014
Interfacial Properties of Monolayer and Bilayer MoS2 Contacts with Metals: Beyond the Energy Band Calculations Zhong, Hongxia; Quhe, Ruge; Wang, Yangyang Scientific Reports, Vol. 6, Issue 1 https://doi.org/10.1038/srep21786	journal	March 2016
Non-aqueous solvents for DNP surface enhanced NMR spectroscopy Zagdoun, Alexandre; Rossini, Aaron J.; Gajan, David Chem. Commun., Vol. 48, Issue 5 https://doi.org/10.1039/C1CC15242D	journal	January 2012
Combining solid-state NMR spectroscopy with first-principles calculations – a guide to NMR crystallography Ashbrook, Sharon E.; McKay, David Chemical Communications, Vol. 52, Issue 45 https://doi.org/10.1039/C6CC02542K	journal	January 2016
Multi-principal element transition metal dichalcogenides via reactive fusion of 3D-heterostructures Hlova, Ihor Z.; Dolotko, Oleksandr; Boote, Brett W. Chemical Communications, Vol. 54, Issue 89 https://doi.org/10.1039/C8CC06766J	journal	January 2018
Direct intercalation of MoS₂ and WS₂ thin films by vacuum filtration Kuo, Ding-Yuan; Cossairt, Brandi M. Materials Horizons, Vol. 9, Issue 1 https://doi.org/10.1039/D1MH01193F	journal	January 2022
Incommensurate transition-metal dichalcogenides via mechanochemical reshuffling of binary precursors Hlova, Ihor Z.; Singh, Prashant; Malynych, Serhiy Z. Nanoscale Advances, Vol. 3, Issue 14 https://doi.org/10.1039/D1NA00064K	journal	January 2021
Solid state NMR studies of photoluminescent cadmium chalcogenide nanoparticles Ratcliffe, Christopher I.; Yu, Kui; Ripmeester, John A. Physical Chemistry Chemical Physics, Vol. 8, Issue 30 https://doi.org/10.1039/b606507b	journal	January 2006
Natural abundance solid-state 95Mo MAS NMR of MoS2 reveals precise 95Mo anisotropic parameters from its central and satellite transitions Jakobsen, Hans J.; Bildsøe, Henrik; Skibsted, Jørgen Chemical Communications, Vol. 46, Issue 12 https://doi.org/10.1039/b926699b	journal	January 2010
Solid-state dynamic nuclear polarization at 263 GHz: spectrometer design and experimental results Rosay, Melanie; Tometich, Leo; Pawsey, Shane Physical Chemistry Chemical Physics, Vol. 12, Issue 22 https://doi.org/10.1039/c003685b	journal	January 2010
Lattice dynamics in mono- and few-layer sheets of WS2 and WSe2 Zhao, Weijie; Ghorannevis, Zohreh; Amara, Kiran Kumar Nanoscale, Vol. 5, Issue 20 https://doi.org/10.1039/c3nr03052k	journal	January 2013
Active guests in the MoS ₂ /MoSe ₂ host lattice: efficient hydrogen evolution using few-layer alloys of MoS _2(1−x) Se _2x Kiran, Vankayala; Mukherjee, Debdyuti; Jenjeti, Ramesh Naidu Nanoscale, Vol. 6, Issue 21 https://doi.org/10.1039/c4nr03716b	journal	January 2014
Proton‐enhanced NMR of dilute spins in solids Pines, A.; Gibby, M. G.; Waugh, J. S. The Journal of Chemical Physics, Vol. 59, Issue 2 https://doi.org/10.1063/1.1680061	journal	July 1973
Modified Spin‐Echo Method for Measuring Nuclear Relaxation Times Meiboom, S.; Gill, D. Review of Scientific Instruments, Vol. 29, Issue 8 https://doi.org/10.1063/1.1716296	journal	August 1958
Dynamic nuclear polarization at high magnetic fields Maly, Thorsten; Debelouchina, Galia T.; Bajaj, Vikram S. The Journal of Chemical Physics, Vol. 128, Issue 5 https://doi.org/10.1063/1.2833582	journal	February 2008
Temperature dependent Raman spectroscopy of chemically derived few layer MoS 2 and WS 2 nanosheets Thripuranthaka, M.; Kashid, Ranjit V.; Sekhar Rout, Chandra Applied Physics Letters, Vol. 104, Issue 8 https://doi.org/10.1063/1.4866782	journal	February 2014
Optical properties of monolayer transition metal dichalcogenides probed by spectroscopic ellipsometry Liu, Hsiang-Lin; Shen, Chih-Chiang; Su, Sheng-Han Applied Physics Letters, Vol. 105, Issue 20 https://doi.org/10.1063/1.4901836	journal	November 2014
High-field QCPMG-MAS NMR of half-integer quadrupolar nuclei with large quadrupole couplings Larsen, Flemming H.; Jakobsen, Hans J.; Ellis, Paul D. Molecular Physics, Vol. 95, Issue 6 https://doi.org/10.1080/00268979809483250	journal	December 1998
The symmetry-resolved electronic structure of 2H-WSe₂(0 0 0 1) Tanabe, Iori; Komesu, Takashi; Le, Duy Journal of Physics: Condensed Matter, Vol. 28, Issue 34 https://doi.org/10.1088/0953-8984/28/34/345503	journal	June 2016
⁷⁷Se NMR study of the charge density wave state in 2H-NbSe₂and 1T-VSe₂ Skripov, A. V.; Sibirtsev, D. S.; Cherepanov, Yu G. Journal of Physics: Condensed Matter, Vol. 7, Issue 23 https://doi.org/10.1088/0953-8984/7/23/016	journal	June 1995
Magneto photoluminescence measurements of tungsten disulphide monolayers Kuhnert, Jan; Rahimi-Iman, Arash; Heimbrodt, Wolfram Journal of Physics: Condensed Matter, Vol. 29, Issue 8 https://doi.org/10.1088/1361-648X/aa55a9	journal	January 2017
Quaternary, layered, 2D chalcogenide, Mo_1−xW_xSSe: thickness dependent transport properties Kumar, Rajat; Jenjeti, Ramesh Naidu; Vankayala, Kiran Nanotechnology, Vol. 35, Issue 4 https://doi.org/10.1088/1361-6528/ad01c1	journal	November 2023
Effects of Diffusion on Free Precession in Nuclear Magnetic Resonance Experiments Carr, H. Y.; Purcell, E. M. Physical Review, Vol. 94, Issue 3 https://doi.org/10.1103/PhysRev.94.630	journal	May 1954
Charge-density wave amplitudes in 2 H − Nb Se 2 and 2 H − Ta Se 2 determined by Se 77 NMR Borsa, F.; Torgeson, D. R.; Shanks, H. R. Physical Review B, Vol. 15, Issue 10 https://doi.org/10.1103/PhysRevB.15.4576	journal	May 1977
Se77NMR study of the electronic instability in TiSe2 Dupree, R.; Warren, W. W.; DiSalvo, F. J. Physical Review B, Vol. 16, Issue 3 https://doi.org/10.1103/PhysRevB.16.1001	journal	August 1977
All-electron magnetic response with pseudopotentials: NMR chemical shifts Pickard, Chris J.; Mauri, Francesco Physical Review B, Vol. 63, Issue 24 https://doi.org/10.1103/PhysRevB.63.245101	journal	May 2001
Calculation of NMR chemical shifts for extended systems using ultrasoft pseudopotentials Yates, Jonathan R.; Pickard, Chris J.; Mauri, Francesco Physical Review B, Vol. 76, Issue 2 https://doi.org/10.1103/PhysRevB.76.024401	journal	July 2007
Influence of quantum confinement on the electronic structure of the transition metal sulfide T S 2 Kuc, A.; Zibouche, N.; Heine, T. Physical Review B, Vol. 83, Issue 24 https://doi.org/10.1103/PhysRevB.83.245213	journal	June 2011
NMR Study of Semiconductor Molecular Clusters Thayer, A. M.; Steigerwald, M. L.; Duncan, T. M. Physical Review Letters, Vol. 60, Issue 25 https://doi.org/10.1103/PhysRevLett.60.2673	journal	June 1988
The thermal expansion of 2 H -MoS ₂ and 2 H -WSe ₂ between 10 and 320 K Murray, R.; Evans, B. Journal of Applied Crystallography, Vol. 12, Issue 3 https://doi.org/10.1107/S0021889879012528	journal	June 1979
The limit of application of the Scherrer equation Miranda, M. A. R.; Sasaki, J. M. Acta Crystallographica Section A Foundations and Advances, Vol. 74, Issue 1 https://doi.org/10.1107/S2053273317014929	journal	January 2018
Two-Dimensional Nanosheets Produced by Liquid Exfoliation of Layered Materials Coleman, J. N.; Lotya, M.; O'Neill, A. Science, Vol. 331, Issue 6017, p. 568-571 https://doi.org/10.1126/science.1194975	journal	February 2011
First principles methods using CASTEP Clark, Stewart J.; Segall, Matthew D.; Pickard, Chris J. Zeitschrift für Kristallographie - Crystalline Materials, Vol. 220, Issue 5/6 https://doi.org/10.1524/zkri.220.5.567.65075	journal	January 2005
Thickness-Dependent Differential Reflectance Spectra of Monolayer and Few-Layer MoS2, MoSe2, WS2 and WSe2 Niu, Yue; Gonzalez-Abad, Sergio; Frisenda, Riccardo Nanomaterials, Vol. 8, Issue 9 https://doi.org/10.3390/nano8090725	journal	September 2018

Similar Records

Electronic structure, surface doping, and optical response in epitaxial WSe₂ thin films

Journal Article · 2016 · Nano Letters · OSTI ID:1257732

Zhang, Yi; Ugeda, Miguel M.; Jin, Chenhao; +15 more

A review of the application of 2D isotropic-anisotropic correlation NMR spectroscopy in structural studies of chalcogenide glasses

Journal Article · 2020 · Journal of Non-Crystalline Solids · OSTI ID:1699493

Kaseman, Derrick C.; Sen, Sabyasachi

Rapid acquisition of data dense solid-state CPMG NMR spectral sets using multi-dimensional statistical analysis

Journal Article · 2018 · Physical Chemistry Chemical Physics. PCCP (Print) · OSTI ID:1463021

Mason, H. E.; Uribe, E. C.; Shusterman, J. A.

Related Subjects

36 MATERIALS SCIENCE
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
Diffraction
Materials
Mixtures
Nuclear magnetic resonance spectroscopy
Oxides

Title: Structural Studies of Alloyed and Nanoparticle Transition Metal Dichalcogenides by Selenium-77 Solid-State Nuclear Magnetic Resonance Spectroscopy

Citation Formats

References (86)

Similar Records

Related Subjects