SCOPUS 정보 검색 플랫폼

Topics in Catalysis

Volumn 53, Issue 5-6, 2010, Pages 423-430

Water adsorption on TiO2

(3) Hammer, B a Wendt, S a Besenbacher, F a

a AARHUS UNIVERSITY (Denmark)

Author keywords

Density functional theory; Scanning tunneling microscopy; Surface reaction; TiO2; Titania; Water

Indexed keywords

ADSORBED WATER; BONDING GEOMETRY; DFT CALCULATION; HIGH RESOLUTION; REACTION PATHWAYS; REDUCTION OF OXYGEN; RUTILE TIO; SCANNING TUNNELING MICROSCOPY (STM); TIO; TITANIA; WATER ADSORPTION; WATER DIMERS; WATER DISSOCIATION; WATER SPECIES;

ADSORPTION; DENSITY FUNCTIONAL THEORY; DIMERS; OXIDE MINERALS; OXYGEN; OXYGEN VACANCIES; SCANNING; SCANNING TUNNELING MICROSCOPY; SURFACE REACTIONS; TITANIUM DIOXIDE;

DEWATERING;

EID: 77957140183 PISSN: 10225528 EISSN: None Source Type: Journal
DOI: 10.1007/s11244-010-9454-3 Document Type: Conference Paper

Times cited : (106)

References (74)

1
- 0006483573
- 2 films
- DOI 10.1038/353737a0
- B O'Regan M Grätzel 1991 Nature 353 737 10.1038/353737a0 (Pubitemid 21738149)
- (1991) Nature , vol.353 , Issue.6346 , pp. 737
- O'Regan, B.¹ Graetzel, M.²

2
- 0037233037
- 10.1016/S0167-5729(02)00100-0 1:CAS:528:DC%2BD3sXivVWqtQ%3D%3D
- U Diebold 2003 Surf Sci Rep 48 53 10.1016/S0167-5729(02)00100-0 1:CAS:528:DC%2BD3sXivVWqtQ%3D%3D
- (2003) Surf Sci Rep , vol.48 , pp. 53
- Diebold, U.¹

3
- 56349101581
- 10.1016/j.surfrep.2008.10.001 1:CAS:528:DC%2BD1cXhsVWhurvP
- A Fujishima X Zhang DA Tryk 2008 Surf Sci Rep 63 515 10.1016/j.surfrep. 2008.10.001 1:CAS:528:DC%2BD1cXhsVWhurvP
- (2008) Surf Sci Rep , vol.63 , pp. 515
- Fujishima, A.¹ Zhang, X.² Tryk, D.A.³

4
- 0002515371
- 10.1021/cr980011z 1:CAS:528:DyaK1cXotFaju78%3D
- GE Brown VE Henrich WH Casey DL Clark C Eggleston A Felmy DW Goodman M Grätzel G Maciel MI McCarthy KH Nealson DA Sverjensky MF Toney JM Zachara 1999 Chem Rev 99 77 10.1021/cr980011z 1:CAS:528:DyaK1cXotFaju78%3D
- (1999) Chem Rev , vol.99 , pp. 77
- Brown, G.E.¹ Henrich, V.E.² Casey, W.H.³ Clark, D.L.⁴ Eggleston, C.⁵ Felmy, A.⁶ Goodman, D.W.⁷ Grätzel, M.⁸ MacIel, G.⁹ McCarthy, M.I.¹⁰ Nealson, K.H.¹¹ Sverjensky, D.A.¹² Toney, M.F.¹³ Zachara, J.M.¹⁴

5
- 0035340991
- Teeth and bones: Applications of surface science to dental materials and related biomaterials
- DOI 10.1016/S0167-5729(00)00011-X, PII S016757290000011X
- FH Jones 2001 Surf Sci Rep 42 79 10.1016/S0167-5729(00)00011-X (Pubitemid 32377156)
- (2001) Surface Science Reports , vol.42 , Issue.3-5 , pp. 75-205
- Jones, F.H.¹

6
- 33751239787
- 2 - New photochemical processes
- DOI 10.1021/cr050172k
- TL Thompson JT Yates Jr 2006 Chem. Rev. 106 4428 10.1021/cr050172k 1:CAS:528:DC%2BD28XhtVGgs7nN (Pubitemid 44782244)
- (2006) Chemical Reviews , vol.106 , Issue.10 , pp. 4428-4453
- Thompson, T.L.¹ Yates Jr., J.T.²

7
- 52649121891
- 10.1039/b719085a 1:CAS:528:DC%2BD1cXhtFKhurzO
- CL Pang R Lindsay G Thornton 2008 Chem Soc Rev 37 2328 10.1039/b719085a 1:CAS:528:DC%2BD1cXhtFKhurzO
- (2008) Chem Soc Rev , vol.37 , pp. 2328
- Pang, C.L.¹ Lindsay, R.² Thornton, G.³

8
- 34249815219
- Oxygen vacancies in transition metal and rare earth oxides: Current state of understanding and remaining challenges
- DOI 10.1016/j.surfrep.2007.03.002, PII S0167572907000295
- MV Ganduglia-Pirovano A Hofmann J Sauer 2007 Surf Sci Rep 62 219 10.1016/j.surfrep.2007.03.002 1:CAS:528:DC%2BD2sXmt1yjsLs%3D (Pubitemid 46856734)
- (2007) Surface Science Reports , vol.62 , Issue.6 , pp. 219-270
- Ganduglia-Pirovano, M.V.¹ Hofmann, A.² Sauer, J.³

9
- 27744531029
- Revisiting the surface structure of TiO2(110): A quantitative low-energy electron diffraction study
- DOI 10.1103/PhysRevLett.94.246102, 246102
- R Lindsay A Wander A Ernst B Montanari G Thornton NM Harrison 2005 Phys Rev Lett 94 246102 10.1103/PhysRevLett.94.246102 (Pubitemid 41636487)
- (2005) Physical Review Letters , vol.94 , Issue.24 , pp. 1-4
- Lindsay, R.¹ Wander, A.² Ernst, A.³ Montanari, B.⁴ Thornton, G.⁵ Harrison, N.M.⁶

10
- 34347399094
- 10.1103/PhysRevB.75.241403
- G Cabailh X Torrelles R Lindsay O Bikondoa I Journard J Zegenhagen G Thornton 2007 Phys Rev B 75 241403 10.1103/PhysRevB.75.241403
- (2007) Phys Rev B , vol.75 , pp. 241403
- Cabailh, G.¹ Torrelles, X.² Lindsay, R.³ Bikondoa, O.⁴ Journard, I.⁵ Zegenhagen, J.⁶ Thornton, G.⁷

11
- 0032165445
- 10.1016/S0039-6028(98)00464-6
- RE Tanner MR Castell GAD Briggs 1998 Surf Sci 412/413 413 10.1016/S0039-6028(98)00464-6
- (1998) Surf Sci , vol.412-413 , pp. 413
- Tanner, R.E.¹ Castell, M.R.² Briggs, G.A.D.³

12
- 0030216319
- 10.1103/PhysRevLett.77.1322 1:CAS:528:DyaK28XltVejsb4%3D
- U Diebold JF Andersen KO Ng D Vanderbilt 1996 Phys Rev Lett 77 1322 10.1103/PhysRevLett.77.1322 1:CAS:528:DyaK28XltVejsb4%3D
- (1996) Phys Rev Lett , vol.77 , pp. 1322
- Diebold, U.¹ Andersen, J.F.² Ng, K.O.³ Vanderbilt, D.⁴

13
- 0001538026
- 10.1103/PhysRevLett.84.2156 1:CAS:528:DC%2BD3cXhsV2mtrg%3D
- S Suzuki K Fukui H Onishi Y Iwasawa 2000 Phys Rev Lett 84 2156 10.1103/PhysRevLett.84.2156 1:CAS:528:DC%2BD3cXhsV2mtrg%3D
- (2000) Phys Rev Lett , vol.84 , pp. 2156
- Suzuki, S.¹ Fukui, K.² Onishi, H.³ Iwasawa, Y.⁴

14
- 0035945160
- 10.1103/PhysRevLett.87.266103 1:STN:280:DC%2BD38%2FnsVClsA%3D%3D
- IM Brookes CA Muryn G Thornton 2001 Phys Rev Lett 87 266103 10.1103/PhysRevLett.87.266103 1:STN:280:DC%2BD38%2FnsVClsA%3D%3D
- (2001) Phys Rev Lett , vol.87 , pp. 266103
- Brookes, I.M.¹ Muryn, C.A.² Thornton, G.³

15
- 0035945227
- 10.1103/PhysRevLett.87.266104 1:STN:280:DC%2BD38%2FnsVClsQ%3D%3D
- R Schaub R Thostrup N Lopez E Lægsgaard I Stensgaard JK Nørskov F Besenbacher 2001 Phys Rev Lett 87 266104 10.1103/PhysRevLett. 87.266104 1:STN:280:DC%2BD38%2FnsVClsQ%3D%3D
- (2001) Phys Rev Lett , vol.87 , pp. 266104
- Schaub, R.¹ Thostrup, R.² Lopez, N.³ Lægsgaard, E.⁴ Stensgaard, I.⁵ Nørskov, J.K.⁶ Besenbacher, F.⁷

16
- 0037449539
- 2(110) surface
- DOI 10.1126/science.1078962
- R Schaub E Wahlström A Ronnau E Lægsgaard I Stensgaard F Besenbacher 2003 Science 299 377 10.1126/science.1078962 1:CAS:528: DC%2BD3sXjsF2ktw%3D%3D (Pubitemid 36120037)
- (2003) Science , vol.299 , Issue.5605 , pp. 377-379
- Schaub, R.¹ Wahlstrom, E.² Ronnau, A.³ Laegsgaard, E.⁴ Stensgaard, I.⁵ Besenbacher, F.⁶

17
- 38349189995
- R Schaub 2006 Science 314 5801
- (2006) Science , vol.314 , pp. 5801
- Schaub, R.¹

18
- 28244484756
- 2: A combined high-resolution STM and DFT study
- DOI 10.1016/j.susc.2005.08.041, PII S0039602805010629
- S Wendt R Schaub J Matthiesen EK Vestergaard E Wahlström MD Rasmussen P Thostrup LM Molina E Lægsgaard I Stensgaard B Hammer F Besenbacher 2005 Surf Sci 598 226 10.1016/j.susc.2005.08.041 1:CAS:528:DC%2BD2MXht1yjtL%2FI (Pubitemid 41706170)
- (2005) Surface Science , vol.598 , Issue.1-3 , pp. 226-245
- Wendt, S.¹ Schaub, R.² Matthiesen, J.³ Vestergaard, E.K.⁴ Wahlstrom, E.⁵ Rasmussen, M.D.⁶ Thostrup, P.⁷ Molina, L.M.⁸ Laegsgaard, E.⁹ Stensgaard, I.¹⁰ Hammer, B.¹¹ Besenbacher, F.¹²

19
- 33751263370
- 1:CAS:528:DC%2BD28XhtVaku7zF
- Z Zhang O Bondarchuk BD Kay JM White Z Dohnálek 2006 J Phys Chem 110 21840 1:CAS:528:DC%2BD28XhtVaku7zF
- (2006) J Phys Chem , vol.110 , pp. 21840
- Zhang, Z.¹ Bondarchuk, O.² Kay, B.D.³ White, J.M.⁴ Dohnálek, Z.⁵

20
- 33846086499
- 2(110) surfaces and their reactivity
- DOI 10.1088/0957-4484/17/21/019, PII S0957448406285362, 019
- CL Pang O Bikondoa DS Humphrey AC Papageorgiou G Cabailh R Ithnin Q Chen CA Muryn H Onishi G Thornton 2006 Nanotechnology 17 5397 10.1088/0957-4484/17/ 21/019 1:CAS:528:DC%2BD2sXisF2lsg%3D%3D (Pubitemid 46069308)
- (2006) Nanotechnology , vol.17 , Issue.21 , pp. 5397-5405
- Pang, C.L.¹ Bikondoa, O.² Humphrey, D.S.³ Papageorgiou, A.C.⁴ Cabailh, G.⁵ Ithnin, R.⁶ Chen, Q.⁷ Muryn, C.A.⁸ Onishi, H.⁹ Thornton, G.¹⁰

21
- 33644613740
- 2(110)
- DOI 10.1038/nmat1592
- O Bikondoa CL Pang R Ithnin CA Muryn H Onishi G Thornton 2006 Nat Mater 5 189 10.1038/nmat1592 1:CAS:528:DC%2BD28XhvV2is7Y%3D (Pubitemid 43320633)
- (2006) Nature Materials , vol.5 , Issue.3 , pp. 189-192
- Bikondoa, O.¹ Pang, C.L.² Ithnin, R.³ Muryn, C.A.⁴ Onishi, H.⁵ Thornton, G.⁶

22
- 77956588284
- 10.1103/PhysRevLett.96.066107 1:STN:280:DC%2BD283gtlyltA%3D%3D
- S Wendt J Matthiesen R Schaub EK Vestergaard E Lægsgaard F Besenbacher B Hammer 2006 Phys Rev Lett 96 066107 10.1103/PhysRevLett.96.066107 1:STN:280:DC%2BD283gtlyltA%3D%3D
- (2006) Phys Rev Lett , vol.96 , pp. 066107
- Wendt, S.¹ Matthiesen, J.² Schaub, R.³ Vestergaard, E.K.⁴ Lægsgaard, E.⁵ Besenbacher, F.⁶ Hammer, B.⁷

23
- 47349115797
- 2(110)
- DOI 10.1021/ja8012825
- SC Li Z Zhang D Sheppard BD Kay JM White Y Du I Lyubinetsky G Henkelman Z Dohnálek 2008 J Am Chem Soc 130 9080 10.1021/ja8012825 1:CAS:528:DC%2BD1cXntlKrsLg%3D (Pubitemid 352000847)
- (2008) Journal of the American Chemical Society , vol.130 , Issue.28 , pp. 9080-9088
- Li, S.-C.¹ Zhang, Z.² Sheppard, D.³ Kay, B.D.⁴ White, J.M.⁵ Du, Y.⁶ Lyubinetsky, I.⁷ Henkelman, G.⁸ Dohnalek, Z.⁹

24
- 63249093834
- 10.1021/jp807030n 1:CAS:528:DC%2BD1cXhsVWksrvP
- Y Du NA Deskins Z Zhang Z Dohnálek M Dupuis I Lyubinetsky 2009 J Phys Chem C 113 666 10.1021/jp807030n 1:CAS:528:DC%2BD1cXhsVWksrvP
- (2009) J Phys Chem C , vol.113 , pp. 666
- Du, Y.¹ Deskins, N.A.² Zhang, Z.³ Dohnálek, Z.⁴ Dupuis, M.⁵ Lyubinetsky, I.⁶

25
- 61649091320
- 10.1021/jp809001x 1:CAS:528:DC%2BD1MXkvVOlsQ%3D%3D
- Z Zhang Y Du NG Petrik GA Kimmel I Lyubinetsky Z Dohnálek 2009 J Phys Chem C 113 1908 10.1021/jp809001x 1:CAS:528:DC%2BD1MXkvVOlsQ%3D%3D
- (2009) J Phys Chem C , vol.113 , pp. 1908
- Zhang, Z.¹ Du, Y.² Petrik, N.G.³ Kimmel, G.A.⁴ Lyubinetsky, I.⁵ Dohnálek, Z.⁶

26
- 63249123154
- 10.1103/PhysRevLett.102.096102 1:STN:280:DC%2BD1Mzgt1Ghtg%3D%3D
- Y Du NA Deskins Z Zhang Z Dohnálek M Dupuis I Lyubinetsky 2009 Phys Rev Lett 102 096102 10.1103/PhysRevLett.102.096102 1:STN:280: DC%2BD1Mzgt1Ghtg%3D%3D
- (2009) Phys Rev Lett , vol.102 , pp. 096102
- Du, Y.¹ Deskins, N.A.² Zhang, Z.³ Dohnálek, Z.⁴ Dupuis, M.⁵ Lyubinetsky, I.⁶

27
- 66249148695
- 10.1103/PhysRevLett.102.226101 1:STN:280:DC%2BD1MrktFGjsg%3D%3D
- J Matthiesen J∅ Hansen S Wendt E Lira R Schaub E Lægsgaard F Besenbacher B Hammer 2009 Phys Rev Lett 102 226101 10.1103/PhysRevLett.102. 226101 1:STN:280:DC%2BD1MrktFGjsg%3D%3D
- (2009) Phys Rev Lett , vol.102 , pp. 226101
- Matthiesen, J.¹ Hansen, J.² Wendt, S.³ Lira, E.⁴ Schaub, R.⁵ Lægsgaard, E.⁶ Besenbacher, F.⁷ Hammer, B.⁸

28
- 65249118225
- 10.1021/nn8008245 1:CAS:528:DC%2BD1MXhs1Slurs%3D
- J Matthiesen S Wendt J∅ Hansen GKH Madsen E Lira P Galliker EK Vestergaard R Schaub E Lægsgaard B Hammer F Besenbacher 2009 ACS Nano 3 517 10.1021/nn8008245 1:CAS:528:DC%2BD1MXhs1Slurs%3D
- (2009) ACS Nano , vol.3 , pp. 517
- Matthiesen, J.¹ Wendt, S.² Hansen, J.³ Madsen, G.K.H.⁴ Lira, E.⁵ Galliker, P.⁶ Vestergaard, E.K.⁷ Schaub, R.⁸ Lægsgaard, E.⁹ Hammer, B.¹⁰ Besenbacher, F.¹¹

29
- 63649107808
- 10.1063/1.3082408
- T Minato Y Sainoo Y Kim HS Kato K Aika M Kawai J Zhao H Petek T Huang W He B Wang Z Wang U Zhao JL Yang JG Hou 2009 J Chem Phys 130 124502 10.1063/1.3082408
- (2009) J Chem Phys , vol.130 , pp. 124502
- Minato, T.¹ Sainoo, Y.² Kim, Y.³ Kato, H.S.⁴ Aika, K.⁵ Kawai, M.⁶ Zhao, J.⁷ Petek, H.⁸ Huang, T.⁹ He, W.¹⁰ Wang, B.¹¹ Wang, Z.¹² Zhao, U.¹³ Yang, J.L.¹⁴ Hou, J.G.¹⁵

30
- 68349092711
- 10.1021/jp901657u 1:CAS:528:DC%2BD1MXotV2ntL4%3D
- XF Cui Z Wang SJ Tan B Wang JL Yang JG Hou 2009 J Phys Chem C 113 13204 10.1021/jp901657u 1:CAS:528:DC%2BD1MXotV2ntL4%3D
- (2009) J Phys Chem C , vol.113 , pp. 13204
- Cui, X.F.¹ Wang, Z.² Tan, S.J.³ Wang, B.⁴ Yang, J.L.⁵ Hou, J.G.⁶

31
- 34047203048
- 2(110)
- DOI 10.1126/science.1135752
- D Matthey JG Wang S Wendt J Matthiesen R Schaub E Lægsgaard B Hammer F Besenbacher 2007 Science 315 1692 10.1126/science.1135752 1:CAS:528:DC%2BD2sXjtlWnt7Y%3D (Pubitemid 46530645)
- (2007) Science , vol.315 , Issue.5819 , pp. 1692-1696
- Matthey, D.¹ Wang, J.G.² Wendt, S.³ Matthiesen, J.⁴ Schaub, R.⁵ Laegsgaard, E.⁶ Hammer, B.⁷ Besenbacher, F.⁸

32
- 33749342051
- Role of Au+ in supporting and activating Au7 on TiO2(110)
- DOI 10.1103/PhysRevLett.97.136107
- JG Wang B Hammer 2006 Phys Rev Lett 97 136107 10.1103/PhysRevLett.97. 136107 1:STN:280:DC%2BD28rpslCrsg%3D%3D (Pubitemid 44496549)
- (2006) Physical Review Letters , vol.97 , Issue.13 , pp. 136107
- Wang, J.G.¹ Hammer, B.²

33
- 46449090235
- The role of interstitial sites in the Ti3d defect state in the band gap of titania
- DOI 10.1126/science.1159846
- S Wendt PT Sprunger E Lira GKH Madsen Z Li JO Hansen J Matthiesen A Blekinge-Rasmussen E Lægsgaard B Hammer F Besenbacher 2008 Science 320 1755 10.1126/science.1159846 1:CAS:528:DC%2BD1cXnsF2ru7Y%3D (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

34
- 0036571188
- 10.1016/S0167-5729(01)00020-6 1:CAS:528:DC%2BD38XjtlKksLw%3D
- MA Henderson 2002 Surf Sci Rep 46 1 10.1016/S0167-5729(01)00020-6 1:CAS:528:DC%2BD38XjtlKksLw%3D
- (2002) Surf Sci Rep , vol.46 , pp. 1
- Henderson, M.A.¹

35
- 67349101769
- 10.1016/j.progsurf.2009.01.002 1:CAS:528:DC%2BD1MXmtVWls78%3D
- L-M Liu P Crawford P Hu 2009 Prog Surf Sci 84 155 10.1016/j.progsurf. 2009.01.002 1:CAS:528:DC%2BD1MXmtVWls78%3D
- (2009) Prog Surf Sci , vol.84 , pp. 155
- Liu, L.-M.¹ Crawford, P.² Hu, P.³

36
- 0000121205
- 10.1016/0039-6028(89)90626-2 1:CAS:528:DyaL1MXlvVWntbg%3D
- RL Kurtz R Stockbauer TE Madey E Roman JL Desegovia 1989 Surf Sci 218 178 10.1016/0039-6028(89)90626-2 1:CAS:528:DyaL1MXlvVWntbg%3D
- (1989) Surf Sci , vol.218 , pp. 178
- Kurtz, R.L.¹ Stockbauer, R.² Madey, T.E.³ Roman, E.⁴ Desegovia, J.L.⁵

37
- 0028370285
- 10.1016/0039-6028(94)90837-0 1:CAS:528:DyaK2cXhslChu7c%3D
- MB Hugenschmidt L Gamble CT Campbell 1994 Surf Sci 302 329 10.1016/0039-6028(94)90837-0 1:CAS:528:DyaK2cXhslChu7c%3D
- (1994) Surf Sci , vol.302 , pp. 329
- Hugenschmidt, M.B.¹ Gamble, L.² Campbell, C.T.³

38
- 34347362977
- 2(110) surfaces revealed by ambient pressure X-ray photoelectron spectroscopy
- DOI 10.1021/jp068606i
- G Ketteler S Yamamoto H Bluhm K Andersson DE Starr DF Ogletree H Ogasawara A Nilsson M Salmeron 2007 J Phys Chem C 111 8278 10.1021/jp068606i 1:CAS:528:DC%2BD2sXltlWksb8%3D (Pubitemid 47012681)
- (2007) Journal of Physical Chemistry C , vol.111 , Issue.23 , pp. 8278-8282
- Ketteler, G.¹ Yamamoto, S.² Bluhm, H.³ Andersson, K.⁴ Starr, D.E.⁵ Ogletree, D.F.⁶ Ogasawara, H.⁷ Nilsson, A.⁸ Salmeron, M.⁹

39
- 0030172935
- 10.1016/0039-6028(95)01357-1 1:CAS:528:DyaK28Xjs1antr4%3D
- MA Henderson 1996 Surf Sci 355 151 10.1016/0039-6028(95)01357-1 1:CAS:528:DyaK28Xjs1antr4%3D
- (1996) Surf Sci , vol.355 , pp. 151
- Henderson, M.A.¹

40
- 0001106858
- 10.1021/la960360t 1:CAS:528:DyaK28XlvVSltrk%3D
- MA Henderson 1996 Langmuir 12 5093 10.1021/la960360t 1:CAS:528: DyaK28XlvVSltrk%3D
- (1996) Langmuir , vol.12 , pp. 5093
- Henderson, M.A.¹

41
- 0032166666
- 10.1016/S0039-6028(98)00446-4
- WS Epling CHF Peden MA Henderson U Diebold 1998 Surf Sci 412-413 333 10.1016/S0039-6028(98)00446-4
- (1998) Surf Sci , vol.412-413 , pp. 333
- Epling, W.S.¹ Peden, C.H.F.² Henderson, M.A.³ Diebold, U.⁴

42
- 0031702598
- 10.1016/S0039-6028(97)00633-X 1:CAS:528:DyaK1cXhs1WltLY%3D
- D Brinkley M Dietrich T Engel P Farrall G Gantner A Schafer A Szuchmacher 1998 Surf Sci 395 292 10.1016/S0039-6028(97)00633-X 1:CAS:528: DyaK1cXhs1WltLY%3D
- (1998) Surf Sci , vol.395 , pp. 292
- Brinkley, D.¹ Dietrich, M.² Engel, T.³ Farrall, P.⁴ Gantner, G.⁵ Schafer, A.⁶ Szuchmacher, A.⁷

43
- 0037448520
- 10.1021/jp0262113 1:CAS:528:DC%2BD38XpsFCmtr0%3D
- MA Henderson WS Epling CHF Peden CL Perkins 2003 J Phys Chem B 107 534 10.1021/jp0262113 1:CAS:528:DC%2BD38XpsFCmtr0%3D
- (2003) J Phys Chem B , vol.107 , pp. 534
- Henderson, M.A.¹ Epling, W.S.² Peden, C.H.F.³ Perkins, C.L.⁴

44
- 28944455256
- Adsorption bond length for H2O on TiO2(110): A key parameter for theoretical understanding
- DOI 10.1103/PhysRevLett.95.226104, 226104
- F Allegretti S O'Brien M Polcik DI Sayago DP Woodruff 2005 Phys Rev Lett 95 226104 10.1103/PhysRevLett.95.226104 1:STN:280:DC%2BD2Mnps1ymsg%3D%3D (Pubitemid 41782092)
- (2005) Physical Review Letters , vol.95 , Issue.22 , pp. 1-4
- Allegretti, F.¹ O'Brien, S.² Polcik, M.³ Sayago, D.I.⁴ Woodruff, D.P.⁵

45
- 33645230397
- 10.1016/j.susc.2006.01.047 1:CAS:528:DC%2BD28Xisl2ksLg%3D
- F Allegretti S O'Brien M Polcik DI Sayago DP Woodruff 2006 Surf Sci 600 1487 10.1016/j.susc.2006.01.047 1:CAS:528:DC%2BD28Xisl2ksLg%3D
- (2006) Surf Sci , vol.600 , pp. 1487
- Allegretti, F.¹ O'Brien, S.² Polcik, M.³ Sayago, D.I.⁴ Woodruff, D.P.⁵

46
- 19544380223
- 10.1103/PhysRevLett.93.086105
- LA Harris AA Quong 2004 Phys Rev Lett 93 086105 10.1103/PhysRevLett.93. 086105
- (2004) Phys Rev Lett , vol.93 , pp. 086105
- Harris, L.A.¹ Quong, A.A.²

47
- 28144437157
- 2 interaction and reactivity on a model hydroxylated rutile(110) surface
- DOI 10.1021/jp0544181
- A Tilocca C Di Valentin A Selloni 2005 J Phys Chem B 109 20963 10.1021/jp0544181 1:CAS:528:DC%2BD2MXhtFaiu7fJ (Pubitemid 41698357)
- (2005) Journal of Physical Chemistry B , vol.109 , Issue.44 , pp. 20963-20967
- Tilocca, A.¹ Di Valentin, C.² Selloni, A.³

48
- 11544350240
- 10.1103/PhysRevLett.80.762 1:CAS:528:DyaK1cXlsVyguw%3D%3D
- PJD Lindan NM Harrison MJ Gillan 1998 Phys Rev Lett 80 762 10.1103/PhysRevLett.80.762 1:CAS:528:DyaK1cXlsVyguw%3D%3D
- (1998) Phys Rev Lett , vol.80 , pp. 762
- Lindan, P.J.D.¹ Harrison, N.M.² Gillan, M.J.³

49
- 33644623409
- Exothermic water dissociation on the rutile Ti O2 (110) surface
- DOI 10.1103/PhysRevB.72.075439
- PJD Lindan C Zhang 2005 Phys Rev B 72 075439 10.1103/PhysRevB.72.075439 (Pubitemid 43406265)
- (2005) Physical Review B - Condensed Matter and Materials Physics , vol.72 , Issue.7 , pp. 075439
- Lindan, P.J.D.¹ Zhang, C.²

50
- 63249120708
- 10.1103/PhysRevB.79.115410
- PM Kowalski B Meyer D Marx 2009 Phys Rev B 79 115410 10.1103/PhysRevB.79. 115410
- (2009) Phys Rev B , vol.79 , pp. 115410
- Kowalski, P.M.¹ Meyer, B.² Marx, D.³

51
- 78049262335
- http://wiki.fysik.dtu.dk/dacapo

52
- 0036572216
- An object-oriented scripting interface to a legacy electronic structure code
- DOI 10.1109/5992.998641
- SR Bahn KW Jacobsen 2002 Comput Sci Eng 41 56 10.1109/5992.998641 (Pubitemid 34562758)
- (2002) Computing in Science and Engineering , vol.4 , Issue.3 , pp. 56-66
- Bahn, S.R.¹ Jacobsen, K.W.²

53
- 4644265529
- 10.1103/PhysRevB.59.7413
- B Hammer LB Hansen JK Nørskov 1999 Phys Rev B 59 7413 10.1103/PhysRevB.59.7413
- (1999) Phys Rev B , vol.59 , pp. 7413
- Hammer, B.¹ Hansen, L.B.² Nørskov, J.K.³

54
- 0001595715
- 10.1103/PhysRevB.59.10341 1:CAS:528:DyaK1MXisFCntbw%3D
- RA Bennett S Poulston P Stone M Bowker 1999 Phys Rev B 59 10341 10.1103/PhysRevB.59.10341 1:CAS:528:DyaK1MXisFCntbw%3D
- (1999) Phys Rev B , vol.59 , pp. 10341
- Bennett, R.A.¹ Poulston, S.² Stone, P.³ Bowker, M.⁴

55
- 52749099373
- 10.1021/nn700158s 1:CAS:528:DC%2BD2sXhtlOgsrrP
- AC Papageorgiou CL Pang Q Chen G Thornton 2007 ACS NANO 1 409 10.1021/nn700158s 1:CAS:528:DC%2BD2sXhtlOgsrrP
- (2007) ACS NANO , vol.1 , pp. 409
- Papageorgiou, A.C.¹ Pang, C.L.² Chen, Q.³ Thornton, G.⁴

56
- 0033521418
- 10.1016/S0039-6028(98)00778-X 1:CAS:528:DyaK1MXns1emsA%3D%3D
- MA Henderson 1999 Surf Sci 419 174 10.1016/S0039-6028(98)00778-X 1:CAS:528:DyaK1MXns1emsA%3D%3D
- (1999) Surf Sci , vol.419 , pp. 174
- Henderson, M.A.¹

57
- 0000734299
- 10.1021/jp9943272 1:CAS:528:DC%2BD3cXjt1Wlsb8%3D
- M Li W Hebenstreit U Diebold AM Tyryshkin MK Bowman GG Dunham MA Henderson 2000 J Phys Chem B 104 4944 10.1021/jp9943272 1:CAS:528: DC%2BD3cXjt1Wlsb8%3D
- (2000) J Phys Chem B , vol.104 , pp. 4944
- Li, M.¹ Hebenstreit, W.² Diebold, U.³ Tyryshkin, A.M.⁴ Bowman, M.K.⁵ Dunham, G.G.⁶ Henderson, M.A.⁷

58
- 0033359941
- 2(110) surface: A comprehensive study
- DOI 10.1016/S0039-6028(99)00720-7
- M Li W Hebenstreit L Gross U Diebold MA Henderson DR Jennison PA Schultz MP Sears 1999 Surf Sci 437 173 10.1016/S0039-6028(99)00720-7 1:CAS:528:DyaK1MXltV2hsrc%3D (Pubitemid 30500582)
- (1999) Surface Science , vol.437 , Issue.1 , pp. 173-190
- Li, M.¹ Hebenstreit, W.² Gross, L.³ Diebold, U.⁴ Henderson, M.A.⁵ Jennison, D.R.⁶ Schultz, P.A.⁷ Sears, M.P.⁸

59
- 0037101191
- 10.1103/PhysRevB.66.035409
- RD Smith RA Bennett M Bowker 2002 Phys Rev B 66 035409 10.1103/PhysRevB.66.035409
- (2002) Phys Rev B , vol.66 , pp. 035409
- Smith, R.D.¹ Bennett, R.A.² Bowker, M.³

60
- 33846923530
- 10.1103/PhysRevB.75.073203
- H Iddir S Ogut P Zapol ND Browning 2007 Phys Rev B 75 073203 10.1103/PhysRevB.75.073203
- (2007) Phys Rev B , vol.75 , pp. 073203
- Iddir, H.¹ Ogut, S.² Zapol, P.³ Browning, N.D.⁴

61
- 59349099214
- 10.1063/1.3055419
- GKH Madsen B Hammer 2009 J Chem Phys 130 044704 10.1063/1.3055419
- (2009) J Chem Phys , vol.130 , pp. 044704
- Madsen, G.K.H.¹ Hammer, B.²

62
- 0034513054
- Climbing image nudged elastic band method for finding saddle points and minimum energy paths
- DOI 10.1063/1.1329672
- G Henkelman BP Uberuaga H Jonsson 2000 J Chem Phys 113 9901 10.1063/1.1329672 1:CAS:528:DC%2BD3cXosFagurc%3D (Pubitemid 32076883)
- (2000) Journal of Chemical Physics , vol.113 , Issue.22 , pp. 9901-9904
- Henkelman, G.¹ Uberuaga, B.P.² Jonsson, H.³

63
- 23244460838
- 10.1103/PhysRevB.46.6671 1:CAS:528:DyaK38XlvFyks7c%3D
- JP Perdew JA Chevary SH Vosko KA Jackson MR Pederson DJ Singh C Fiolhais 1992 Phys Rev B 46 6671 10.1103/PhysRevB.46.6671 1:CAS:528:DyaK38XlvFyks7c%3D
- (1992) Phys Rev B , vol.46 , pp. 6671
- Perdew, J.P.¹ Chevary, J.A.² Vosko, S.H.³ Jackson, K.A.⁴ Pederson, M.R.⁵ Singh, D.J.⁶ Fiolhais, C.⁷

64
- 0842268393
- 10.1063/1.1631922 1:CAS:528:DC%2BD2cXnsV2q
- MD Rasmussen LM Molina B Hammer 2004 J Chem Phys 120 988 10.1063/1.1631922 1:CAS:528:DC%2BD2cXnsV2q
- (2004) J Chem Phys , vol.120 , pp. 988
- Rasmussen, M.D.¹ Molina, L.M.² Hammer, B.³

65
- 0001081133
- 10.1016/0009-2614(94)00712-8 1:CAS:528:DyaK2cXms1CnsL0%3D
- H Onishi I Iwasawa 1994 Chem Phys Lett 226 111 10.1016/0009-2614(94) 00712-8 1:CAS:528:DyaK2cXms1CnsL0%3D
- (1994) Chem Phys Lett , vol.226 , pp. 111
- Onishi, H.¹ Iwasawa, I.²

66
- 39349104189
- Scanning tunneling microscopy image simulation of the rutile (110) Ti O2 surface with hybrid functionals and the localized basis set approach
- DOI 10.1063/1.2790430
- C Di Valentin 2007 J Chem Phys 127 154705 10.1063/1.2790430 (Pubitemid 351260795)
- (2007) Journal of Chemical Physics , vol.127 , Issue.15 , pp. 154705
- Di Valentin, C.¹

67
- 33847254811
- 2(1 1 0) from first-principles: Defects, water adsorption and dissociation products
- DOI 10.1016/j.cplett.2007.01.068, PII S0009261407001200
- G Teobaldi WA Hofer O Bikondoa CL Pang G Cabailh G Thornton 2007 Chem Phys Lett 437 73 10.1016/j.cplett.2007.01.068 1:CAS:528:DC%2BD2sXisVWgt7s%3D (Pubitemid 46331040)
- (2007) Chemical Physics Letters , vol.437 , Issue.1-3 , pp. 73-78
- Teobaldi, G.¹ Hofer, W.A.² Bikondoa, O.³ Pang, C.L.⁴ Cabailh, G.⁵ Thornton, G.⁶

68
- 33745713702
- Chemical identification of point defects and adsorbates on a metal oxide surface by atomic force microscopy
- DOI 10.1088/0957-4484/17/14/015, PII S0957448406225492, 015
- JV Lauritsen AS Foster GH Olesen MC Christensen A Kühnle S Helveg JR Rostrup-Nielsen BS Clausen M Reichling F Besenbacher 2006 Nanotechnology 17 3436 10.1088/0957-4484/17/14/015 1:CAS:528:DC%2BD28XhtVaksLzK (Pubitemid 43996730)
- (2006) Nanotechnology , vol.17 , Issue.14 , pp. 3436-3441
- Lauritsen, J.V.¹ Foster, A.S.² Olesen, G.H.³ Christensen, M.C.⁴ Kuhnle, A.⁵ Helveg, S.⁶ Rostrup-Nielsen, J.R.⁷ Clausen, B.S.⁸ Reichling, M.⁹ Besenbacher, F.¹⁰

69
- 36148954382
- 10.1103/PhysRevB.76.205415
- GH Enevoldsen AS Foster MC Christensen JV Lauritsen F Besenbacher 2007 Phys Rev B 76 205415 10.1103/PhysRevB.76.205415
- (2007) Phys Rev B , vol.76 , pp. 205415
- Enevoldsen, G.H.¹ Foster, A.S.² Christensen, M.C.³ Lauritsen, J.V.⁴ Besenbacher, F.⁵

70
- 2342482279
- 10.1103/PhysRevLett.92.136104 1:STN:280:DC%2BD2c3itVOruw%3D%3D
- VA Ranea A Michaelides R Ramirez PL de Andres JA Verges DA King 2004 Phys Rev Lett 92 136104 10.1103/PhysRevLett.92.136104 1:STN:280: DC%2BD2c3itVOruw%3D%3D
- (2004) Phys Rev Lett , vol.92 , pp. 136104
- Ranea, V.A.¹ Michaelides, A.² Ramirez, R.³ De Andres, P.L.⁴ Verges, J.A.⁵ King, D.A.⁶

71
- 0001675833
- 10.1021/jp990655q 1:CAS:528:DyaK1MXjsVKmtL4%3D
- MA Henderson WS Epling CL Perkins CHF Peden U Diebold 1999 J Phys Chem B 103 5328 10.1021/jp990655q 1:CAS:528:DyaK1MXjsVKmtL4%3D
- (1999) J Phys Chem B , vol.103 , pp. 5328
- Henderson, M.A.¹ Epling, W.S.² Perkins, C.L.³ Peden, C.H.F.⁴ Diebold, U.⁵

72
- 0035838004
- 2(110)-water ice interface
- DOI 10.1021/jp0031799
- CL Perkins MA Henderson 2001 J Phys Chem B 105 3856 10.1021/jp0031799 1:CAS:528:DC%2BD3MXhslSrt7Y%3D (Pubitemid 35369943)
- (2001) Journal of Physical Chemistry B , vol.105 , Issue.18 , pp. 3856-3863
- Perkins, C.L.¹ Henderson, M.A.²

73
- 26444619077
- 2-based photocatalysis: Surface defects, oxygen and charge transfer
- DOI 10.1007/s11244-005-3825-1
- TL Thompson JT Yates Jr 2005 Top Catal 35 197 10.1007/s11244-005-3825-1 1:CAS:528:DC%2BD2MXhtVGntLvO (Pubitemid 41429832)
- (2005) Topics in Catalysis , vol.35 , Issue.3-4 , pp. 197-210
- Thompson, T.L.¹ Yates Jr., J.T.²

74
- 33645454262
- 10.1021/ja056801p 1:CAS:528:DC%2BD28XhvF2is7c%3D
- LM Liu B McAllister HQ Ye P Hu 2006 J Am Chem Soc 128 4017 10.1021/ja056801p 1:CAS:528:DC%2BD28XhvF2is7c%3D
- (2006) J Am Chem Soc , vol.128 , pp. 4017
- Liu, L.M.¹ McAllister, B.² Ye, H.Q.³ Hu, P.⁴

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