-
1
-
-
84875413255
-
The chemistry of two-dimensional layered transition metal dichalcogenide nanosheets
-
Chhowalla, M.; Shin, H. S.; Eda, G.; Li, L.-J.; Loh, K. P.; Zhang, H. The Chemistry of Two-Dimensional Layered Transition Metal Dichalcogenide Nanosheets. Nat. Chem. 2013, 5, 263-275.
-
(2013)
Nat. Chem.
, vol.5
, pp. 263-275
-
-
Chhowalla, M.1
Shin, H.S.2
Eda, G.3
Li, L.-J.4
Loh, K.P.5
Zhang, H.6
-
2
-
-
82755177414
-
Tunable band gaps in bilayer transition-metal dichalcogenides
-
Ramasubramaniam, A.; Naveh, D.; Towe, E. Tunable Band Gaps in Bilayer Transition-Metal Dichalcogenides. Phys. Rev. B 2011, 84, 205325-205335.
-
(2011)
Phys. Rev. B
, vol.84
, pp. 205325-205335
-
-
Ramasubramaniam, A.1
Naveh, D.2
Towe, E.3
-
3
-
-
84856427874
-
Effects of static charging and exfoliation of layered crystals
-
Topsakal, M.; Ciraci, S. Effects of Static Charging and Exfoliation of Layered Crystals. Phys. Rev. B 2012, 85, 045121-045127.
-
(2012)
Phys. Rev. B
, vol.85
, pp. 045121-045127
-
-
Topsakal, M.1
Ciraci, S.2
-
4
-
-
80455149673
-
Phonons in single-layer and few-layer mos2 and ws2
-
Molina-Sanchez, A.; Wirtz, L. Phonons in Single-Layer and Few-Layer MoS2 and WS2. Phys. Rev. B 2011, 84, 155413-155421.
-
(2011)
Phys. Rev. B
, vol.84
, pp. 155413-155421
-
-
Molina-Sanchez, A.1
Wirtz, L.2
-
5
-
-
80051932226
-
Functionalization of single-layer mos2 honeycomb structures
-
Ataca, C.; Ciraci, S. Functionalization of Single-Layer MoS2 Honeycomb Structures. J. Phys. Chem. C 2011, 115, 13303-13311.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 13303-13311
-
-
Ataca, C.1
Ciraci, S.2
-
6
-
-
79952406873
-
Single-layer mos2 transistors
-
Radisavljevic, B.; Radenovic, A.; Brivio, J.; Giacometti, V.; Kis, A. Single-Layer MoS2 Transistors. Nat. Nanotechnol. 2011, 6, 147-150.
-
(2011)
Nat. Nanotechnol.
, vol.6
, pp. 147-150
-
-
Radisavljevic, B.1
Radenovic, A.2
Brivio, J.3
Giacometti, V.4
Kis, A.5
-
7
-
-
79953210099
-
Mechanical and electronic properties of mos2 nanoribbons and their defects
-
Ataca, C.; Sahin, H.; Akturk, E.; Ciraci, S. Mechanical and Electronic Properties of MoS2 Nanoribbons and Their Defects. J. Phys. Chem. C 2011, 115, 3934-3941.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 3934-3941
-
-
Ataca, C.1
Sahin, H.2
Akturk, E.3
Ciraci, S.4
-
8
-
-
77952896966
-
Anomalous lattice vibrations of single-and few-layer mos2
-
Lee, C.; Yan, H.; Brus, L. E.; Heinz, T. F.; Hone, J.; Ryu, S. Anomalous Lattice Vibrations of Single-and Few-Layer MoS2. ACS Nano 2010, 4, 2695-2700.
-
(2010)
ACS Nano
, vol.4
, pp. 2695-2700
-
-
Lee, C.1
Yan, H.2
Brus, L.E.3
Heinz, T.F.4
Hone, J.5
Ryu, S.6
-
9
-
-
84867522812
-
Tuning electronic structure of bilayer mos2 by vertical electric field: A first-principles investigation
-
Liu, Q.; Li, L.; Li, Y.; Gao, Z.; Chen, Z.; Lu, J. Tuning Electronic Structure of Bilayer MoS2 by Vertical Electric Field: A First-Principles Investigation. J. Phys. Chem. C 2012, 116, 21556-21562.
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 21556-21562
-
-
Liu, Q.1
Li, L.2
Li, Y.3
Gao, Z.4
Chen, Z.5
Lu, J.6
-
10
-
-
84864687591
-
A first principle comparative study of electronic and optical properties of 1h-mos2 and 2h-mos2
-
Kumar, A.; Ahluwalia, P. K. A First Principle Comparative Study of Electronic and Optical Properties of 1H-MoS2 and 2H-MoS2. Mater. Chem. Phys. 2012, 135, 755-761.
-
(2012)
Mater. Chem. Phys.
, vol.135
, pp. 755-761
-
-
Kumar, A.1
Ahluwalia, P.K.2
-
11
-
-
84859059749
-
Frictional figures of merit for single layered nanostructures
-
Cahangirov, S.; Ataca, C.; Topsakal, M.; Sahin, H.; Ciraci, S. Frictional Figures of Merit for Single Layered Nanostructures. Phys. Rev. Lett. 2012, 108, 126103-126107.
-
(2012)
Phys. Rev. Lett.
, vol.108
, pp. 126103-126107
-
-
Cahangirov, S.1
Ataca, C.2
Topsakal, M.3
Sahin, H.4
Ciraci, S.5
-
12
-
-
78650141119
-
A Computational Chemistry Study on Friction of h-mos2. Part II. Friction Anisotropy
-
Onodera, T.; Morita, Y.; Nagumo, R.; Miura, R.; Suzuki, A.; Tsuboi, H.; Hatakeyama, N.; Endou, A.; Takaba, H.; Dassenoy, F.; Minfray, C.; Joly-Pottuz, L.; Kubo, M.; Martin, J.-M.; Miyamoto, A. A Computational Chemistry Study on Friction of h-MoS2. Part II. Friction Anisotropy. J. Phys. Chem. B 2010, 114, 15832-15838.
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 15832-15838
-
-
Onodera, T.1
Morita, Y.2
Nagumo, R.3
Miura, R.4
Suzuki, A.5
Tsuboi, H.6
Hatakeyama, N.7
Endou, A.8
Takaba, H.9
Dassenoy, F.10
Minfray, C.11
Joly-Pottuz, L.12
Kubo, M.13
Martin, J.-M.14
Miyamoto, A.15
-
13
-
-
73349105604
-
A Computational Chemistry Study on Friction of h-mos2. Part I. Mechanism of Single Sheet Lubrication
-
Onodera, T.; Morita, Y.; Suzuki, A.; Koyama, M.; Tsuboi, H.; Hatakeyama, N.; Endou, A.; Takaba, H.; Kubo, M.; Dassenoy, F.; Minfray, C.; Joly-Pottuz, L.; Martin, J.-M.; Miyamoto, A. A Computational Chemistry Study on Friction of h-MoS2. Part I. Mechanism of Single Sheet Lubrication. J. Phys. Chem. B 2009, 113, 16526-16536.
-
(2009)
J. Phys. Chem. B
, vol.113
, pp. 16526-16536
-
-
Onodera, T.1
Morita, Y.2
Suzuki, A.3
Koyama, M.4
Tsuboi, H.5
Hatakeyama, N.6
Endou, A.7
Takaba, H.8
Kubo, M.9
Dassenoy, F.10
Minfray, C.11
Joly-Pottuz, L.12
Martin, J.-M.13
Miyamoto, A.14
-
14
-
-
41449115184
-
First-principles determination of static potential energy surfaces for atomic friction in mos2 and moo3
-
Liang, T.; Sawyer, W. G.; Perry, S. S.; Sinnott, S. B.; Phillpot, S. R. First-Principles Determination of Static Potential Energy Surfaces for Atomic Friction in MoS2 and MoO3. Phys. Rev. B 2008, 77, 104105-104110.
-
(2008)
Phys. Rev. B
, vol.77
, pp. 104105-104110
-
-
Liang, T.1
Sawyer, W.G.2
Perry, S.S.3
Sinnott, S.B.4
Phillpot, S.R.5
-
15
-
-
84864774598
-
Interlayer registry to determine the sliding potential of layered metal dichalcogenides: The case of 2h-mos2
-
Blumberg, A.; Keshet, U.; Zaltsman, I.; Hod, O. Interlayer Registry to Determine the Sliding Potential of Layered Metal Dichalcogenides: The Case of 2H-MoS2. J. Phys. Chem. Lett. 2012, 3, 1936-1940.
-
(2012)
J. Phys. Chem. Lett.
, vol.3
, pp. 1936-1940
-
-
Blumberg, A.1
Keshet, U.2
Zaltsman, I.3
Hod, O.4
-
16
-
-
33144460974
-
Superlubricity of molybdenum disulphide
-
Martin, J.-M.; Donnet, C.; Le Mogne, Th.; Epicier, Th. Superlubricity of Molybdenum Disulphide. Phys. Rev. B 1993, 48, 10583-10586.
-
(1993)
Phys. Rev. B
, vol.48
, pp. 10583-10586
-
-
Martin, J.-M.1
Donnet, C.2
Le Mogne, Th.3
Epicier, Th.4
-
17
-
-
80054123279
-
Review on self-lubricant transition metal dichalcogenide nanocomposite coatings alloyed with carbon
-
Polcar, T.; Cavaleiro, A. Review on Self-Lubricant Transition Metal Dichalcogenide Nanocomposite Coatings Alloyed with Carbon. Surf. Coat. Technol. 2011, 206, 686-695.
-
(2011)
Surf. Coat. Technol.
, vol.206
, pp. 686-695
-
-
Polcar, T.1
Cavaleiro, A.2
-
18
-
-
0000643283
-
Hertzian stress contribution to low friction behavior of thin mos2 coatings
-
Singer, I. L.; Bolster, R. N.; Wegand, J.; Fayeulle, S.; Stupp, B. C. Hertzian Stress Contribution to Low Friction Behavior of Thin MoS2 Coatings. Appl. Phys. Lett. 1990, 57, 995-997.
-
(1990)
Appl. Phys. Lett.
, vol.57
, pp. 995-997
-
-
Singer, I.L.1
Bolster, R.N.2
Wegand, J.3
Fayeulle, S.4
Stupp, B.C.5
-
19
-
-
0037062044
-
Observation of the amontons-coulomb law on the nanoscale: Frictional forces between mos2 flakes and mos2 surfaces
-
Miura, K.; Kamiya, S. Observation of the Amontons-Coulomb Law on the Nanoscale: Frictional Forces between MoS2 Flakes and MoS2 Surfaces. Europhys. Lett. 2002, 58, 610-615.
-
(2002)
Europhys. Lett.
, vol.58
, pp. 610-615
-
-
Miura, K.1
Kamiya, S.2
-
20
-
-
77950480784
-
Frictional characteristics of atomically thin sheets
-
Lee, C.; Li, Q.; Kalb, W.; Liu, X.-Z.; Berger, H.; Carpick, R. W.; Hone, J. Frictional Characteristics of Atomically Thin Sheets. Science 2010, 328, 76-80.
-
(2010)
Science
, vol.328
, pp. 76-80
-
-
Lee, C.1
Li, Q.2
Kalb, W.3
Liu, X.-Z.4
Berger, H.5
Carpick, R.W.6
Hone, J.7
-
21
-
-
84872079111
-
High pressure effect on structure, electronic structure, and thermoelectric properties of mos2
-
Guo, H.; Yang, T.; Tao, P.; Wang, Y.; Zhang, Z. High Pressure Effect on Structure, Electronic Structure, and Thermoelectric Properties of MoS2. J. Appl. Phys. 2013, 113, 013709-013715.
-
(2013)
J. Appl. Phys.
, vol.113
, pp. 013709-013715
-
-
Guo, H.1
Yang, T.2
Tao, P.3
Wang, Y.4
Zhang, Z.5
-
22
-
-
84865230582
-
Role of interlayer coupling in ultra thin mos2
-
Cheng, Y.; Zhu, Z.; Schwingenschlogl, U. Role of Interlayer Coupling in Ultra Thin MoS2. RSC Adv. 2012, 2, 7798-7802.
-
(2012)
RSC Adv.
, vol.2
, pp. 7798-7802
-
-
Cheng, Y.1
Zhu, Z.2
Schwingenschlogl, U.3
-
23
-
-
84871821943
-
Potential energy surface for graphene on graphene: Ab initio derivation, analytical description, and microscopic interpretation
-
Reguzzoni, M.; Fasolino, A.; Molinari, E.; Righi, M. C. Potential Energy Surface for Graphene on Graphene: Ab Initio Derivation, Analytical Description, and Microscopic Interpretation. Phys. Rev. B 2012, 86, 245434-245440.
-
(2012)
Phys. Rev. B
, vol.86
, pp. 245434-245440
-
-
Reguzzoni, M.1
Fasolino, A.2
Molinari, E.3
Righi, M.C.4
-
24
-
-
84860361457
-
Stable, single-layer mx2 transition-metal oxides and dichalcogenides in a honeycomb-like structure
-
Ataca, C.; Sahin, H.; Ciraci, S. Stable, Single-Layer MX2 Transition-Metal Oxides and Dichalcogenides in a Honeycomb-Like Structure. J. Phys. Chem. C 2012, 116, 8983-8999.
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 8983-8999
-
-
Ataca, C.1
Sahin, H.2
Ciraci, S.3
-
25
-
-
49949147297
-
Molybdenum disulfide as a lubricant: A review of the fundamental knowledge
-
Winer, W. O. Molybdenum Disulfide as a Lubricant: A Review of the Fundamental Knowledge. Wear 1967, 10, 422-452.
-
(1967)
Wear
, vol.10
, pp. 422-452
-
-
Winer, W.O.1
-
26
-
-
70349568754
-
Quantum espresso: A modular and open-source software project for quantum simulations of materials
-
Giannozzi, P.; Baroni, S.; Bonini, N.; Calandra, M.; Car, R.; Cavazzoni, C.; Ceresoli, D.; Chiarotti, G. L.; Cococcioni, M.; Dabo, I.; et al. Quantum ESPRESSO: A Modular and Open-Source Software Project for Quantum Simulations of Materials. J. Phys.: Condens. Matter 2009, 21, 395502-39520.
-
(2009)
J. Phys.: Condens. Matter
, vol.21
, pp. 395502-439520
-
-
Giannozzi, P.1
Baroni, S.2
Bonini, N.3
Calandra, M.4
Car, R.5
Cavazzoni, C.6
Ceresoli, D.7
Chiarotti, G.L.8
Cococcioni, M.9
Dabo, I.10
-
27
-
-
0000720337
-
High-precision sampling for brillouin-zone integration in metals
-
Methfessel, M.; Paxton, A. High-Precision Sampling for Brillouin-Zone Integration in Metals. Phys. Rev. B 1989, 40, 3616-3621.
-
(1989)
Phys. Rev. B
, vol.40
, pp. 3616-3621
-
-
Methfessel, M.1
Paxton, A.2
-
28
-
-
33750559983
-
Semiempirical gga-type density functional constructed with a long-range dispersion correction
-
Grimme, S. Semiempirical GGA-Type Density Functional Constructed with a Long-Range Dispersion Correction. J. Comput. Chem. 2006, 27, 1787-1799.
-
(2006)
J. Comput. Chem.
, vol.27
, pp. 1787-1799
-
-
Grimme, S.1
-
29
-
-
78049495810
-
Improved description of the structure of molecular and layered crystals: Ab initio dft calculations with van der waals corrections
-
Bucko, T.; Hafner, J.; Lebegue, S.; Angyan, J. G. Improved Description of the Structure of Molecular and Layered Crystals: Ab Initio DFT Calculations with van der Waals Corrections. J. Phys. Chem. A 2010, 114, 11814-11824.
-
(2010)
J. Phys. Chem. A
, vol.114
, pp. 11814-11824
-
-
Bucko, T.1
Hafner, J.2
Lebegue, S.3
Angyan, J.G.4
-
30
-
-
4243943295
-
Generalized gradient approximation made simple
-
Perdew, J. P.; Burke, M.; Ernzerhof, K. Generalized Gradient Approximation Made Simple. Phys. Rev. Lett. 1996, 77, 3865-3868.
-
(1996)
Phys. Rev. Lett.
, vol.77
, pp. 3865-3868
-
-
Perdew, J.P.1
Burke, M.2
Ernzerhof, K.3
-
31
-
-
20544463457
-
Soft self-consistent pseudopotentials in a generalized eigenvalue formalism
-
Vanderbilt, D. Soft Self-Consistent Pseudopotentials in a Generalized Eigenvalue Formalism. Phys. Rev. B 1990, 41, 7892-7895(R).
-
(1990)
Phys. Rev. B
, vol.41
, pp. 7892-7895R
-
-
Vanderbilt, D.1
-
32
-
-
84861890021
-
Van der waals bonding in layered compounds from advanced density-functional first-principles calculations
-
Bjorkman, T.; Gulans, A.; Krasheninnikov, A. V.; Nieminen, R. M. van der Waals Bonding in Layered Compounds from Advanced Density-Functional First-Principles Calculations. Phys. Rev. Lett. 2012, 108, 235502-235506.
-
(2012)
Phys. Rev. Lett.
, vol.108
, pp. 235502-235506
-
-
Bjorkman, T.1
Gulans, A.2
Krasheninnikov, A.V.3
Nieminen, R.M.4
-
33
-
-
79958014494
-
Ab initio calculation of the adhesion and ideal shear strength of planar diamond interfaces with different atomic structure and hydrogen coverage
-
Zilibotti, G.; Righi, M. C. Ab Initio Calculation of the Adhesion and Ideal Shear Strength of Planar Diamond Interfaces with Different Atomic Structure and Hydrogen Coverage. Langmuir 2011, 27, 6862-6867.
-
(2011)
Langmuir
, vol.27
, pp. 6862-6867
-
-
Zilibotti, G.1
Righi, M.C.2
-
34
-
-
0041588396
-
Calculated specific surface energy of molybdenite (mos2)
-
Weiss, K.; Phillips, J. M. Calculated Specific Surface Energy of Molybdenite (MoS2). Phys. Rev. B 1976, 14, 5392-5395.
-
(1976)
Phys. Rev. B
, vol.14
, pp. 5392-5395
-
-
Weiss, K.1
Phillips, J.M.2
-
35
-
-
80051919620
-
A comparative study of lattice dynamics of three-and two-dimensional mos2
-
Ataca, C.; Topsakal, M.; Akturk, E.; Ciraci, S. A Comparative Study of Lattice Dynamics of Three-and Two-Dimensional MoS2. J. Phys. Chem. C 2011, 115, 16354-16361.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 16354-16361
-
-
Ataca, C.1
Topsakal, M.2
Akturk, E.3
Ciraci, S.4
-
36
-
-
3042702905
-
Ab initio study of 2h-mos2 using hay and wadt effective core pseudo-potentials for modelling the (1010) surface structure
-
Todorova, T.; Alexiev, V.; Prins, R.; Weber, T. Ab Initio Study of 2H-MoS2 Using Hay and Wadt Effective Core Pseudo-Potentials for Modelling the (1010) Surface Structure. Phys. Chem. Chem. Phys. 2004, 6, 3023-3030.
-
(2004)
Phys. Chem. Chem. Phys.
, vol.6
, pp. 3023-3030
-
-
Todorova, T.1
Alexiev, V.2
Prins, R.3
Weber, T.4
-
37
-
-
84859582419
-
Graphite and hexagonal boron-nitride have the same interlayer distance
-
Hod, O. Graphite and Hexagonal Boron-Nitride Have the Same Interlayer Distance. Why. J. Chem. Theory Comput. 2012, 8, 1360-1369.
-
(2012)
Why. J. Chem. Theory Comput.
, vol.8
, pp. 1360-1369
-
-
Hod, O.1
-
39
-
-
84877023282
-
Structure change, layer sliding, and metallization in high-pressure mos2
-
Hromadová, L.; Martonák, R.; Tosatti, E. Structure Change, Layer Sliding, and Metallization in High-pressure MoS2. Phys. Rev. B 2013, 87, 144105-144110.
-
(2013)
Phys. Rev. B
, vol.87
, pp. 144105-144110
-
-
Hromadova, L.1
Martonak, R.2
Tosatti, E.3
-
40
-
-
35548963895
-
Pressure induced friction collapse of rare gas boundary layers sliding over metal surfaces
-
Righi, M. C.; Ferrario, M. Pressure Induced Friction Collapse of Rare Gas Boundary Layers Sliding over Metal Surfaces. Phys. Rev. Lett. 2007, 99, 176101-176104.
-
(2007)
Phys. Rev. Lett.
, vol.99
, pp. 176101-176104
-
-
Righi, M.C.1
Ferrario, M.2
-
41
-
-
76549088279
-
Onset of frictional slip by domain nucleation in adsorbed monolayers
-
Reguzzoni, M.; Ferrario, M.; Zapperi, S.; Righi, M. C. Onset of Frictional Slip by Domain Nucleation in Adsorbed Monolayers. Proc. Natl. Acad. Sci. U. S. A. 2010, 107, 1311-1316.
-
(2010)
Proc. Natl. Acad. Sci. U. S. A.
, vol.107
, pp. 1311-1316
-
-
Reguzzoni, M.1
Ferrario, M.2
Zapperi, S.3
Righi, M.C.4
|