-
1
-
-
0039129509
-
Environmental Applications of Semiconductor Photocatalysis
-
Hoffmann, M. R.; Martin, S. T.; Choi, W.; Bahnemann, D. W. Environmental Applications of Semiconductor Photocatalysis Chem. Rev. 1995, 95, 69-96
-
(1995)
Chem. Rev.
, vol.95
, pp. 69-96
-
-
Hoffmann, M.R.1
Martin, S.T.2
Choi, W.3
Bahnemann, D.W.4
-
2
-
-
4544235448
-
2 Surfaces: Principles, Mechanisms, and Selected Results
-
2 Surfaces: Principles, Mechanisms, and Selected Results Chem. Rev. 1995, 95, 735-58
-
(1995)
Chem. Rev.
, vol.95
, pp. 735-58
-
-
Linsebigler, A.L.1
Lu, G.Q.2
Yates Jr., J.T.3
-
3
-
-
33751239787
-
2 - New photochemical processes
-
DOI 10.1021/cr050172k
-
2-New Photochemical Processes Chem. Rev. 2006, 106, 4428-53 (Pubitemid 44782244)
-
(2006)
Chemical Reviews
, vol.106
, Issue.10
, pp. 4428-4453
-
-
Thompson, T.L.1
Yates Jr., J.T.2
-
4
-
-
79957932124
-
A Surface Science Perspective on Photocatalysis
-
Henderson, M. A. A Surface Science Perspective on Photocatalysis Surf. Sci. Rep. 2011, 66, 185
-
(2011)
Surf. Sci. Rep.
, vol.66
, pp. 185
-
-
Henderson, M.A.1
-
7
-
-
0001675833
-
2(110) surface: Molecular and dissociative channels
-
2(110) Surface: Molecular and Dissociative Channels J. Phys. Chem. B 1999, 103, 5328-37 (Pubitemid 129702807)
-
(1999)
Journal of Physical Chemistry B
, vol.103
, Issue.25
, pp. 5328-5337
-
-
Henderson, M.A.1
Epling, W.S.2
Perkins, C.L.3
Peden, C.H.F.4
Diebold, U.5
-
10
-
-
43849088933
-
2(110): Oxygen Adsorption and Reactions with Bridging Oxygen Vacancies
-
2(110): Oxygen Adsorption and Reactions with Bridging Oxygen Vacancies Phys. Rev. Lett. 2008, 100, 196102-4
-
(2008)
Phys. Rev. Lett.
, vol.100
, pp. 196102-4
-
-
Kimmel, G.A.1
Petrik, N.G.2
-
11
-
-
77957107065
-
2(110): An STM and TPD Study
-
2(110): An STM and TPD Study Surf. Sci. 2010, 604, 1945-60
-
(2010)
Surf. Sci.
, vol.604
, pp. 1945-60
-
-
Lira, E.1
Hansen, Jø.2
Huo, P.3
Bechstein, R.4
Galliker, P.5
Lægsgaard, E.6
Hammer, B.7
Wendt, S.8
Besenbacher, F.9
-
13
-
-
63249123154
-
2(110)
-
2(110) Phys. Rev. Lett. 2009, 102, 096102-4
-
(2009)
Phys. Rev. Lett.
, vol.102
, pp. 096102-4
-
-
Du, Y.1
Deskins, N.A.2
Zhang, Z.3
Dohnalek, Z.4
Dupuis, M.5
Lyubinetsky, I.6
-
14
-
-
68149106157
-
Chemical Reactivity of Reduced TiO2(110): The Dominant Role of Surface Defects in Oxygen Chemisorption
-
Petrik, N. G.; Zhang, Z.; Du, Y.; Dohnalek, Z.; Lyubinetsky, I.; Kimmel, G. A. Chemical Reactivity of Reduced TiO2(110): The Dominant Role of Surface Defects in Oxygen Chemisorption J. Phys. Chem. C 2009, 113, 12407-11
-
(2009)
J. Phys. Chem. C
, vol.113
, pp. 12407-11
-
-
Petrik, N.G.1
Zhang, Z.2
Du, Y.3
Dohnalek, Z.4
Lyubinetsky, I.5
Kimmel, G.A.6
-
17
-
-
79951538798
-
Molecular Oxygen Adsorption Behaviors on the Rutile TiO2(110)-1×1 Surface: An in Situ Study with Low-Temperature Scanning Tunneling Microscopy
-
Tan, S.; Ji, Y.; Zhao, Y.; Zhao, A.; Wang, B.; Yang, J.; Hou, J. G. Molecular Oxygen Adsorption Behaviors on the Rutile TiO2(110)-1×1 Surface: An in Situ Study with Low-Temperature Scanning Tunneling Microscopy J. Am. Chem. Soc. 2011, 133, 2002-9
-
(2011)
J. Am. Chem. Soc.
, vol.133
, pp. 2002-9
-
-
Tan, S.1
Ji, Y.2
Zhao, Y.3
Zhao, A.4
Wang, B.5
Yang, J.6
Hou, J.G.7
-
19
-
-
65149098910
-
2: Mechanisms behind the Surface Chemistry
-
2: Mechanisms Behind the Surface Chemistry Surf. Sci. 2009, 603, 1605-12
-
(2009)
Surf. Sci.
, vol.603
, pp. 1605-12
-
-
Yates Jr., J.T.1
-
22
-
-
46449090235
-
The role of interstitial sites in the Ti3d defect state in the band gap of titania
-
DOI 10.1126/science.1159846
-
3d Defect State in the Band Gap of Titania Science 2008, 320, 1755-9 (Pubitemid 351931286)
-
(2008)
Science
, vol.320
, Issue.5884
, pp. 1755-1759
-
-
Wendt, S.1
Sprunger, P.T.2
Lira, E.3
Madsen, G.K.H.4
Li, Z.5
Hansen, J.O.6
Matthiesen, J.7
Blekinge-Rasmussen, A.8
Laegsgaard, E.9
Hammer, B.10
Besenbacher, F.11
-
23
-
-
77953351459
-
2(110)
-
2(110) Phys. Chem. Chem. Phys. 2010, 12, 6337-44
-
(2010)
Phys. Chem. Chem. Phys.
, vol.12
, pp. 6337-44
-
-
Du, Y.1
Deskins, N.A.2
Zhang, Z.3
Dohnalek, Z.4
Dupuis, M.5
Lyubinetsky, I.6
-
29
-
-
0037233037
-
The Surface Science of Titanium Dioxide
-
Diebold, U. The Surface Science of Titanium Dioxide Surf. Sci. Rep. 2003, 48, 53-229
-
(2003)
Surf. Sci. Rep.
, vol.48
, pp. 53-229
-
-
Diebold, U.1
-
31
-
-
77249129749
-
2(110)
-
2(110) Proc. Natl. Acad. Sci. U.S.A. 2010, 107, 2391-6
-
(2010)
Proc. Natl. Acad. Sci. U.S.A.
, vol.107
, pp. 2391-6
-
-
Papageorgiou, A.C.1
Beglitis, N.S.2
Pang, C.L.3
Teobaldi, G.4
Cabailh, G.5
Chen, Q.6
Fisher, A.J.7
Hofer, W.A.8
Thornton, G.9
-
32
-
-
48149086253
-
Reproducible Tip Fabrication and Cleaning for UHV STM
-
Yu, Z. Q.; Wang, C. M.; Du, Y.; Thevuthasan, S.; Lyubinetsky, I. Reproducible Tip Fabrication and Cleaning for UHV STM Ultramicroscopy 2008, 108, 873-7
-
(2008)
Ultramicroscopy
, vol.108
, pp. 873-7
-
-
Yu, Z.Q.1
Wang, C.M.2
Du, Y.3
Thevuthasan, S.4
Lyubinetsky, I.5
-
33
-
-
77957887127
-
2(110)
-
2(110) J. Phys. Chem. C 2010, 114, 17080-4
-
(2010)
J. Phys. Chem. C
, vol.114
, pp. 17080-4
-
-
Du, Y.1
Deskins, N.A.2
Zhang, Z.3
Dohnalek, Z.4
Dupuis, M.5
Lyubinetsky, I.6
-
34
-
-
77957886201
-
-
Accessed October 20, 2011
-
CP2K Developers Home Page, 2009. http://cp2k.berlios.de. Accessed October 20, 2011.
-
(2009)
CP2K Developers Home Page
-
-
-
35
-
-
15344345714
-
Quickstep: Fast and accurate density functional calculations using a mixed Gaussian and plane waves approach
-
DOI 10.1016/j.cpc.2004.12.014, PII S0010465505000615
-
Van de Vondele, J.; Krack, M.; Mohamed, F.; Parrinello, M.; Chassaing, T.; Hutter, J. Quickstep: Fast and Accurate Density Functional Calculations Using a Mixed Gaussian and Plane Waves Approach Comput. Phys. Commun. 2005, 167, 103-28 (Pubitemid 40391124)
-
(2005)
Computer Physics Communications
, vol.167
, Issue.2
, pp. 103-128
-
-
Vandevondele, J.1
Krack, M.2
Mohamed, F.3
Parrinello, M.4
Chassaing, T.5
Hutter, J.6
-
36
-
-
0033262620
-
The Gaussian and Augmented-Plane-Wave Density Functional Method for Ab Initio Molecular Dynamics Simulations
-
Lippert, G.; Hutter, J.; Parrinello, M. The Gaussian and Augmented-Plane-Wave Density Functional Method for Ab Initio Molecular Dynamics Simulations Theor. Chem. Acc. 1999, 103, 124-40
-
(1999)
Theor. Chem. Acc.
, vol.103
, pp. 124-40
-
-
Lippert, G.1
Hutter, J.2
Parrinello, M.3
-
37
-
-
25144446255
-
Pseudopotentials for H to Kr optimized for gradient-corrected exchange-correlation functionals
-
DOI 10.1007/s00214-005-0655-y
-
Krack, M. Pseudopotentials for H to Kr Optimized for Gradient-Corrected Exchange-Correlation Functionals Theor. Chem. Acc. 2005, 114, 145-52 (Pubitemid 41355884)
-
(2005)
Theoretical Chemistry Accounts
, vol.114
, Issue.1-3
, pp. 145-152
-
-
Krack, M.1
-
38
-
-
0002928871
-
Atoms in Molecules
-
Bader, R. F. W. Atoms in Molecules Acc. Chem. Res. 1985, 18, 9-15
-
(1985)
Acc. Chem. Res.
, vol.18
, pp. 9-15
-
-
Bader, R.F.W.1
-
39
-
-
4243943295
-
Generalized Gradient Approximation Made Simple
-
Perdew, J. P.; Burke, K.; Ernzerhof, M. Generalized Gradient Approximation Made Simple Phys. Rev. Lett. 1996, 77, 3865
-
(1996)
Phys. Rev. Lett.
, vol.77
, pp. 3865
-
-
Perdew, J.P.1
Burke, K.2
Ernzerhof, M.3
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