-
1
-
-
0000943021
-
On the crystal structure of molybdenum trioxide
-
Andersson, G. & Magneli, A. On the crystal structure of molybdenum trioxide. Acta Chem. Scand. 4, 793-797 (1950).
-
(1950)
Acta Chem. Scand
, vol.4
, pp. 793-797
-
-
Andersson, G.1
Magneli, A.2
-
2
-
-
1642267201
-
Anisotropic thermal expansion of layered MoO 3 crystals
-
Negishi, H., Negishi, S., Kuroiwa, Y., Sato, N. & Aoyagi, S. Anisotropic thermal expansion of layered MoO 3 crystals. Phys. Rev. B 69, 064111 (2004).
-
(2004)
Phys. Rev. B
, vol.69
-
-
Negishi, H.1
Negishi, S.2
Kuroiwa, Y.3
Sato, N.4
Aoyagi, S.5
-
3
-
-
0037454325
-
Catalytic gas phase oxidation of methanol to formaldehyde
-
Waters, T.,O'Hair, R. A. &Wedd, A. G. Catalytic gas phase oxidation of methanol to formaldehyde. J. Am. Chem. Soc. 125, 3384-3396 (2003).
-
(2003)
J. Am. Chem. Soc
, vol.125
, pp. 3384-3396
-
-
Waters, T.1
O'Hair, R.A.2
Wedd, A.G.3
-
4
-
-
0000726437
-
Photochromism induced in an electrolytically pretreated Mo03 thin film by visible light
-
Yao, J., Hashimoto, K. & Fujishima, A. Photochromism induced in an electrolytically pretreated Mo03 thin film by visible light. Nature 355, 624-626 (1992).
-
(1992)
Nature
, vol.355
, pp. 624-626
-
-
Yao, J.1
Hashimoto, K.2
Fujishima, A.3
-
5
-
-
0029921952
-
Photoelectrochromic windows and displays
-
Bechinger, C., Ferrere, S., Zaban, A., Sprague, J. & Gregg, B. A. Photoelectrochromic windows and displays. Nature 383, 608-610 (1996).
-
(1996)
Nature
, vol.383
, pp. 608-610
-
-
Bechinger, C.1
Ferrere, S.2
Zaban, A.3
Sprague, J.4
Gregg, B.A.5
-
6
-
-
36248936082
-
Lithiated MoO3 nanobelts with greatly improved performance for lithium batteries
-
Mai, L. Q. et al. Lithiated MoO3 nanobelts with greatly improved performance for lithium batteries. Adv. Mater. 19, 3712-3716 (2007).
-
(2007)
Adv. Mater
, vol.19
, pp. 3712-3716
-
-
Mai, L.Q.1
-
7
-
-
84882951675
-
Thin-film metal oxides in organic semiconductor devices: Their electronic structures, work functions and interfaces
-
Greiner, M. T. & Lu, Z.-H. Thin-film metal oxides in organic semiconductor devices: their electronic structures, work functions and interfaces. NPG Asia Mater. 5, e55. doi:10.1038/am.2013.29 (2013).
-
(2013)
NPG Asia Mater
, vol.5
, pp. e55
-
-
Greiner, M.T.1
Lu, Z.-H.2
-
8
-
-
84867496876
-
Transition metal oxides for organic electronics: Energetics, device physics and applications
-
Meyer, J. et al. Transition metal oxides for organic electronics: energetics, device physics and applications. Adv. Mater. 24, 5408-5427 (2012).
-
(2012)
Adv. Mater
, vol.24
, pp. 5408-5427
-
-
Meyer, J.1
-
9
-
-
84872061851
-
Metal/Metal-Oxide Interfaces: HowMetal Contacts Affect the Work Function and Band Structure of MoO3
-
Greiner,M. T. et al.Metal/Metal-Oxide Interfaces: HowMetal Contacts Affect the Work Function and Band Structure of MoO3. Adv. Funct. Mater. 23, 215-226 (2013).
-
(2013)
Adv. Funct. Mater
, vol.23
, pp. 215-226
-
-
Greiner, M.T.1
-
10
-
-
40549114323
-
Comparative Study on MoO3 and HxMoO3 Nanobelts: Structure and Electric Transport
-
Hu, X. K. et al. Comparative Study on MoO3 and HxMoO3 Nanobelts: Structure and Electric Transport. Chem. Mater. 20, 1527-1533 (2008).
-
(2008)
Chem. Mater
, vol.20
, pp. 1527-1533
-
-
Hu, X.K.1
-
11
-
-
84872016726
-
Enhanced Charge Carrier Mobility in Two-Dimensional High Dielectric Molybdenum Oxide
-
Balendhran, S. et al. Enhanced Charge Carrier Mobility in Two-Dimensional High Dielectric Molybdenum Oxide. Adv. Mater. 25, 109-114 (2013).
-
(2013)
Adv. Mater
, vol.25
, pp. 109-114
-
-
Balendhran, S.1
-
12
-
-
84882728465
-
Two-Dimensional Molybdenum Trioxide and Dichalcogenides
-
Balendhran, S. et al. Two-Dimensional Molybdenum Trioxide and Dichalcogenides. Adv. Funct. Mater 23, 3952-3970 (2013).
-
(2013)
Adv. Funct. Mater
, vol.23
, pp. 3952-3970
-
-
Balendhran, S.1
-
13
-
-
84856508264
-
Structural and vibrational properties of a-MoO3 from van der Waals corrected density functional theory calculations
-
Ding, H., Ray, K. G., Ozolins, V. & Asta, M. Structural and vibrational properties of a-MoO3 from van der Waals corrected density functional theory calculations. Phys. Rev. B 85, 012104 (2012).
-
(2012)
Phys. Rev. B
, vol.85
-
-
Ding, H.1
Ray, K.G.2
Ozolins, V.3
Asta, M.4
-
14
-
-
67649832377
-
Hydrogen absorption and diffusion in bulk a-MoO3
-
Sha, X., Chen, L., Cooper, A. C., Pez, G. P. & Cheng, H. Hydrogen absorption and diffusion in bulk a-MoO3. J. Phys. Chem. C 113, 11399-11407 (2009).
-
(2009)
J. Phys. Chem. C
, vol.113
, pp. 11399-11407
-
-
Sha, X.1
Chen, L.2
Cooper, A.C.3
Pez, G.P.4
Cheng, H.5
-
15
-
-
84871007144
-
DFT 1 U study of properties of MoO3 and hydrogen adsorption on MoO3 (010)
-
Lei, Y.-H. & Chen, Z.-X. DFT 1 U study of properties of MoO3 and hydrogen adsorption on MoO3 (010). J. Phys. Chem. C 116, 25757-25764 (2012).
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 25757-25764
-
-
Lei, Y.-H.1
Chen, Z.-X.2
-
16
-
-
28444467027
-
The (010) surface of a-MoO3, a DFT1U study
-
Coquet, R. &Willock, D. J. The (010) surface of a-MoO3, a DFT1U study. Phys. Chem. Chem. Phys. 7, 3819-3828 (2005).
-
(2005)
Phys. Chem. Chem. Phys
, vol.7
, pp. 3819-3828
-
-
Coquet, R.1
Willock, D.J.2
-
17
-
-
77949463830
-
Theoretical and experimental study of the electronic structures of MoO3 and MoO2
-
Scanlon, D. O. et al. Theoretical and experimental study of the electronic structures of MoO3 and MoO2. J. Phys. Chem. C 114, 4636-4645 (2010).
-
(2010)
J. Phys. Chem. C
, vol.114
, pp. 4636-4645
-
-
Scanlon, D.O.1
-
18
-
-
79955448424
-
Density functional theory study of acetaldehyde hydrodeoxygenation on MoO3
-
Mei, D., Karim, A.M. &Wang, Y. Density functional theory study of acetaldehyde hydrodeoxygenation on MoO3. J. Phys. Chem. C 115, 8155-8164 (2011).
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 8155-8164
-
-
Mei, D.1
Karim, A.M.2
Wang, Y.3
-
19
-
-
0030190741
-
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
-
Kresse, G. & Furthmüller, J. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Comput. Mater. Sci. 6, 15-50 (1996).
-
(1996)
Comput. Mater. Sci
, vol.6
, pp. 15-50
-
-
Kresse, G.1
Furthmüller, J.2
-
20
-
-
2442537377
-
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
-
Kresse, G. & Furthmüller, J. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set. Phys. Rev. B 54, 11169 (1996).
-
(1996)
Phys. Rev. B
, vol.54
-
-
Kresse, G.1
Furthmüller, J.2
-
21
-
-
25744460922
-
Projector augmented-wave method
-
Blöchl, P. E. Projector augmented-wave method. Phys. Rev. B 50, 17953 (1994).
-
(1994)
Phys. Rev. B
, vol.50
-
-
Blöchl, P.E.1
-
22
-
-
0011236321
-
From ultrasoft pseudopotentials to the projector augmented wave method
-
Kresse, G. & Joubert, D. From ultrasoft pseudopotentials to the projector augmented wave method. Phys. Rev. B 59, 1758 (1999)
-
(1999)
Phys. Rev. B
, vol.59
, pp. 1758
-
-
Kresse, G.1
Joubert, D.2
-
23
-
-
4243943295
-
Generalized gradient approximation made simple
-
Perdew, J. P., Burke, K. & Ernzerhof, M. Generalized gradient approximation made simple. Phys. Rev. Lett. 77, 3865-3868 (1996).
-
(1996)
Phys. Rev. Lett
, vol.77
, pp. 3865-3868
-
-
Perdew, J.P.1
Burke, K.2
Ernzerhof, M.3
-
24
-
-
3242718844
-
Van der Waals density functional for general geometries
-
Dion, M., Rydberg, H., Schröder, E., Langreth, D. C. & Lundqvist, B. I. Van der Waals density functional for general geometries. Phys. Rev. Lett. 92, 246401 (2004).
-
(2004)
Phys. Rev. Lett
, vol.92
-
-
Dion, M.1
Rydberg, H.2
Schröder, E.3
Langreth, D.C.4
Lundqvist, B.I.5
-
26
-
-
79960645403
-
Van der Waals density functionals applied to solids
-
Klimeš, J., Bowler, D. R. & Michaelides, A. Van der Waals density functionals applied to solids. Phys. Rev. B 83, 195131 (2011).
-
(2011)
Phys. Rev. B
, vol.83
-
-
Klimeš, J.1
Bowler, D.R.2
Michaelides, A.3
-
27
-
-
84878723192
-
Tuning electronic and magnetic properties of MoO3 sheets by cutting, hydrogenation, and external strain: A computational investigation
-
Li, F. & Chen, Z. Tuning electronic and magnetic properties of MoO3 sheets by cutting, hydrogenation, and external strain: a computational investigation. Nanoscale 5, 5321-5333 (2013).
-
(2013)
Nanoscale
, vol.5
, pp. 5321-5333
-
-
Li, F.1
Chen, Z.2
-
28
-
-
84867637361
-
Tuning Magnetism and Electronic Phase Transitions by Strain and Electric Field in Zigzag MoS2 Nanoribbons
-
Kou, L. et al. Tuning Magnetism and Electronic Phase Transitions by Strain and Electric Field in Zigzag MoS2 Nanoribbons. J. Phys. Chem. Lett 3, 2934-2941(2012).
-
(2012)
J. Phys. Chem. Lett
, vol.3
, pp. 2934-2941
-
-
Kou, L.1
-
29
-
-
13844316981
-
Tuning electronic properties of novel metal oxide nanocrystals using interface interactions: MoO3 monolayers on Au (111)
-
Quek, S. Y., Biener, M. M., Biener, J., Friend, C.M. & Kaxiras, E. Tuning electronic properties of novel metal oxide nanocrystals using interface interactions: MoO3 monolayers on Au (111). Surf. Sci. 577, L71-L77 (2005).
-
(2005)
Surf. Sci
, vol.577
, pp. L71-L77
-
-
Quek, S.Y.1
Biener, M.M.2
Biener, J.3
Friend, C.M.4
Kaxiras, E.5
-
30
-
-
33745753520
-
A fast and robust algorithm for Bader decomposition of charge density
-
Henkelman, G., Arnaldsson, A. & Jónsson, H. A fast and robust algorithm for Bader decomposition of charge density. Comput. Mater. Sci. 36, 354-360 (2006).
-
(2006)
Comput. Mater. Sci
, vol.36
, pp. 354-360
-
-
Henkelman, G.1
Arnaldsson, A.2
Jónsson, H.3
-
31
-
-
0035817120
-
Optical properties and electronic structures of layered MoO3 single crystals
-
Itoh, M., Hayakawa, K. & Oishi, S. Optical properties and electronic structures of layered MoO3 single crystals. J. Phys.: Condens. Matter 13, 6853 (2001).
-
(2001)
J. Phys.: Condens. Matter
, vol.13
, pp. 6853
-
-
Itoh, M.1
Hayakawa, K.2
Oishi, S.3
-
32
-
-
84876583377
-
Atwo-electron mechanism of lithium insertion into layered a-MoO3: A DFT and DFT 1 U study
-
Baldoni, M., Craco, L., Seifert, G.&Leoni, S.Atwo-electron mechanism of lithium insertion into layered a-MoO3: a DFT and DFT 1 U study. J. Mater. Chem. A 1, 1778-1784 (2013).
-
(2013)
J. Mater. Chem. A
, vol.1
, pp. 1778-1784
-
-
Baldoni, M.1
Craco, L.2
Seifert, G.3
Leoni, S.4
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