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Volumn 367, Issue 2, 1996, Pages 135-148

The energetics of adsorption of HCOOH on the MgO(100) surface

b WARSAW UNIVERSITY OF TECHNOLOGY (Poland)

Author keywords

Carboxylic acid; Chemisorption; Density functional calculations; Insulating surfaces; Low index single crystal surfaces; Magnesium oxides; Surface chemical reaction

Indexed keywords

ADSORPTION; BOUNDARY CONDITIONS; CARBOXYLIC ACIDS; CHEMISORPTION; DISSOCIATION; MAGNESIA; SURFACE PHENOMENA;

DENSITY FUNCTIONAL THEORY; LOW INDEX SINGLE CRYSTAL SURFACES; PSEUDOPOTENTIAL METHOD;

SINGLE CRYSTALS;

EID: 0030288497 PISSN: 00396028 EISSN: None Source Type: Journal
DOI: 10.1016/S0039-6028(96)00870-9 Document Type: Article

Times cited : (36)

References (46)

1
- 0009710262
- A. Scamehorn, A.C. Hess and M.I. McCarthy, J. Chem. Phys. 99 (1993) 2786.
- (1993) J. Chem. Phys. , vol.99 , pp. 2786
- Scamehorn, A.¹ Hess, A.C.² McCarthy, M.I.³

2
- 36449009441
- A. Scamehorn, N.M. Harrison and M.I. McCarthy, J. Chem. Phys. 101 (1994) 1547.
- (1994) J. Chem. Phys. , vol.101 , pp. 1547
- Scamehorn, A.¹ Harrison, N.M.² McCarthy, M.I.³

3
- 35448982349
- W. Langel and M. Parrinello, J. Chem. Phys. 103 (1995) 3240.
- (1995) J. Chem. Phys. , vol.103 , pp. 3240
- Langel, W.¹ Parrinello, M.²

4
- 0001418171
- K. Refson, R.A. Wogelius, D.G. Fraser, M.C. Payne, M.-H. Lee and V. Milman, Phys. Rev. B 52 (1995) 10823.
- (1995) Phys. Rev. B , vol.52 , pp. 10823
- Refson, K.¹ Wogelius, R.A.² Fraser, D.G.³ Payne, M.C.⁴ Lee, M.-H.⁵ Milman, V.⁶

5
- 0030129363
- J. Goniakowski and M.J. Gillan, Surf. Sci. 350 (1996) 145.
- (1996) Surf. Sci. , vol.350 , pp. 145
- Goniakowski, J.¹ Gillan, M.J.²

6
- 0029357124
- H. Nakatsuji, M. Yoshimoto, M. Hada, K. Domen and C. Hirose, Surf. Sci. 336 (1995) 232.
- (1995) Surf. Sci. , vol.336 , pp. 232
- Nakatsuji, H.¹ Yoshimoto, M.² Hada, M.³ Domen, K.⁴ Hirose, C.⁵

7
- 10644250257
- P. Hohenberg and W. Kohn, Phys. Rev. 136 (1964) B864.
- (1964) Phys. Rev. , vol.136
- Hohenberg, P.¹ Kohn, W.²

8
- 0042113153
- W. Kohn and L.J. Sham, Phys. Rev. 140 (1965) A1133.
- (1965) Phys. Rev. , vol.140
- Kohn, W.¹ Sham, L.J.²

9
- 51149210200
- R.O. Jones and O. Gunnarsson, Rev. Mod. Phys. 61 (1989) 689.
- (1989) Rev. Mod. Phys. , vol.61 , pp. 689
- Jones, R.O.¹ Gunnarsson, O.²

10
- 0039887362
- Aussois, 1991, Eds. M. Meyer and V. Pontikis Kluwer, Dordrecht
- M.J. Gillan, in: Proc. NATO ASI on Computer Simulation in Materials Science, Aussois, 1991, Eds. M. Meyer and V. Pontikis (Kluwer, Dordrecht, 1991) p. 257.
- (1991) Proc. NATO ASI on Computer Simulation in Materials Science , pp. 257
- Gillan, M.J.¹

11
- 11944256577
- M.C. Payne, M.P. Teter, D.C. Allan, T.A. Arias and J.D. Joannopoulos, Rev. Mod. Phys. 64 (1992) 1045.
- (1992) Rev. Mod. Phys. , vol.64 , pp. 1045
- Payne, M.C.¹ Teter, M.P.² Allan, D.C.³ Arias, T.A.⁴ Joannopoulos, J.D.⁵

12
- 0027576430
- I. Manassidis, A. De Vita and M.J. Gillan, Surf. Sci. 285 (1993) L517.
- (1993) Surf. Sci. , vol.285
- Manassidis, I.¹ De Vita, A.² Gillan, M.J.³

13
- 0028382717
- I. Manassidis and M.J. Gillan, J. Am. Ceram. Soc. 77 (1994) 335.
- (1994) J. Am. Ceram. Soc. , vol.77 , pp. 335
- Manassidis, I.¹ Gillan, M.J.²

14
- 0028730982
- S. Pugh and M.J. Gillan, Surf. Sci. 320 (1994) 331.
- (1994) Surf. Sci. , vol.320 , pp. 331
- Pugh, S.¹ Gillan, M.J.²

15
- 0029543675
- L.N. Kantorovich, J.M. Holender and M.J. Gillan, Surf. Sci. 343 (1995) 221.
- (1995) Surf. Sci. , vol.343 , pp. 221
- Kantorovich, L.N.¹ Holender, J.M.² Gillan, M.J.³

16
- 0029393427
- I. Manassidis, J. Goniakowski, L.N. Kantorovich and M.J. Gillan, Surf. Sci. 339 (1995) 258.
- (1995) Surf. Sci. , vol.339 , pp. 258
- Manassidis, I.¹ Goniakowski, J.² Kantorovich, L.N.³ Gillan, M.J.⁴

17
- 33744596259
- D.C. Langreth and M.J. Mehl, Phys. Rev. B 28 (1983) 1809.
- (1983) Phys. Rev. B , vol.28 , pp. 1809
- Langreth, D.C.¹ Mehl, M.J.²

18
- 5944261746
- J.P. Perdew, Phys. Rev. B 33 (1986) 8822.
- (1986) Phys. Rev. B , vol.33 , pp. 8822
- Perdew, J.P.¹

19
- 18144378706
- J.P. Perdew and Y. Wang, Phys. Rev. B 33 (1986) 8800.
- (1986) Phys. Rev. B , vol.33 , pp. 8800
- Perdew, J.P.¹ Wang, Y.²

20
- 4243553426
- A.D. Becke, Phys. Rev. A 38 (1988) 3098.
- (1988) Phys. Rev. A , vol.38 , pp. 3098
- Becke, A.D.¹

21
- 0001681221
- X.J. Kong, C.T. Chan, K.M. Ho and Y.Y. Ye, Phys. Rev. B 42 (1990) 9357.
- (1990) Phys. Rev. B , vol.42 , pp. 9357
- Kong, X.J.¹ Chan, C.T.² Ho, K.M.³ Ye, Y.Y.⁴

22
- 0001559866
- A. García, C. Elsässer, J. Zhu, S.G. Louie and M.L. Cohen, Phys. Rev. B 46 (1992) 9829.
- (1992) Phys. Rev. B , vol.46 , pp. 9829
- García, A.¹ Elsässer, C.² Zhu, J.³ Louie, S.G.⁴ Cohen, M.L.⁵

23
- 3342950640
- J.A. White, D.M. Bird, M.C. Payne and I. Štich, Phys. Rev. Lett. 73 (1994) 1404.
- (1994) Phys. Rev. Lett. , vol.73 , pp. 1404
- White, J.A.¹ Bird, D.M.² Payne, M.C.³ Štich, I.⁴

24
- 43949151924
- P. Hu, D.A. King, S. Crampin, M.H. Lee and M.C. Payne, Chem. Phys. Lett. 230 (1994) 501.
- (1994) Chem. Phys. Lett. , vol.230 , pp. 501
- Hu, P.¹ King, D.A.² Crampin, S.³ Lee, M.H.⁴ Payne, M.C.⁵

25
- 0028400425
- K. Gundersen, K.W. Jacobsen, J.K. Nørskov and B. Hammer, Surf. Sci. 304 (1994) 131.
- (1994) Surf. Sci. , vol.304 , pp. 131
- Gundersen, K.¹ Jacobsen, K.W.² Nørskov, J.K.³ Hammer, B.⁴

26
- 0026938185
- L.J. Clarke, I. Stich and M.C. Payne, Comput. Phys. Commun. 72 (1992) 14.
- (1992) Comput. Phys. Commun. , vol.72 , pp. 14
- Clarke, L.J.¹ Stich, I.² Payne, M.C.³

27
- 1842816907
- H.J. Monkhorst and J.D. Pack, Phys. Rev. B 13 (1976) 5188.
- (1976) Phys. Rev. B , vol.13 , pp. 5188
- Monkhorst, H.J.¹ Pack, J.D.²

28
- 0000933655
- J.A. White and D.M. Bird, Phys. Rev. B 50 (1994) 4954.
- (1994) Phys. Rev. B , vol.50 , pp. 4954
- White, J.A.¹ Bird, D.M.²

29
- 4243825171
- L. Kleinman and D.M. Bylander, Phys. Rev. Lett. 48 (1980) 566.
- (1980) Phys. Rev. Lett. , vol.48 , pp. 566
- Kleinman, L.¹ Bylander, D.M.²

30
- 3743131895
- G.P. Kerker, J. Phys. C 13 (1980) L189.
- (1980) J. Phys. C , vol.13
- Kerker, G.P.¹

31
- 0000965622
- I. Nahringbauer, Acta Crystallogr. B 34 (1978) 315.
- (1978) Acta Crystallogr. B , vol.34 , pp. 315
- Nahringbauer, I.¹

32
- 0000695985
- A. Almenningen, O. Bastiansen and T. Motzfeldt, Acta Chem. Scand. 23 (1969) 2848.
- (1969) Acta Chem. Scand. , vol.23 , pp. 2848
- Almenningen, A.¹ Bastiansen, O.² Motzfeldt, T.³

33
- 0003638901
- McGraw-Hill, New York
- Lange's Handbook of Chemistry (McGraw-Hill, New York, 1985).
- (1985) Lange's Handbook of Chemistry

34
- 0000690491
- M. Causà, R. Dovesi, C. Pisani and C. Roetti, Surf. Sci. 175 (1986) 551.
- (1986) Surf. Sci. , vol.175 , pp. 551
- Causà, M.¹ Dovesi, R.² Pisani, C.³ Roetti, C.⁴

35
- 0000291767
- M.R. Welton-Cook and W. Berndt, J. Phys. C 15 (1982) 5691.
- (1982) J. Phys. C , vol.15 , pp. 5691
- Welton-Cook, M.R.¹ Berndt, W.²

36
- 0003187765
- T. Urano, T. Kanaji and M. Kaboragi, Surf. Sci. 134 (1983) 109.
- (1983) Surf. Sci. , vol.134 , pp. 109
- Urano, T.¹ Kanaji, T.² Kaboragi, M.³

37
- 84910917797
- D.L. Blanchard, D.L. Lessor, J.P. LaFemina, D.R. Baer, W.K. Ford and T. Guo, J. Vac. Sci. Technol. A 9 (1991) 1814.
- (1991) J. Vac. Sci. Technol. A , vol.9 , pp. 1814
- Blanchard, D.L.¹ Lessor, D.L.² LaFemina, J.P.³ Baer, D.R.⁴ Ford, W.K.⁵ Guo, T.⁶

38
- 3042885536
- J. Goniakowski, J.M. Holender, L.N. Kantorovich, M.J. Gillan and J.A. White, Phys. Rev. B 53 (1996) 957.
- (1996) Phys. Rev. B , vol.53 , pp. 957
- Goniakowski, J.¹ Holender, J.M.² Kantorovich, L.N.³ Gillan, M.J.⁴ White, J.A.⁵

39
- 35949006855
- A. De Vita, M.J. Gillan, J.-S. Lin, M.C. Payne, I. Štich and L.J. Clarke, Phys. Rev. B 46 (1992) 12964.
- (1992) Phys. Rev. B , vol.46 , pp. 12964
- De Vita, A.¹ Gillan, M.J.² Lin, J.-S.³ Payne, M.C.⁴ Štich, I.⁵ Clarke, L.J.⁶

40
- 36449009257
- D.A. Arthur, D.L. Meixner, M. Boudart and S.M. George, J. Chem. Phys. 95 (1991) 8521.
- (1991) J. Chem. Phys. , vol.95 , pp. 8521
- Arthur, D.A.¹ Meixner, D.L.² Boudart, M.³ George, S.M.⁴

41
- 0001004441
- C.F. Jones, R.A. Reeve, R. Rigg, R.L. Segall, R.St.C. Smart and P.S. Turner, J. Chem. Soc., Faraday Trans. I, 80 (1984) 2609.
- (1984) J. Chem. Soc., Faraday Trans. I , vol.80 , pp. 2609
- Jones, C.F.¹ Reeve, R.A.² Rigg, R.³ Segall, R.L.⁴ Smart, R.St.C.⁵ Turner, P.S.⁶

42
- 0010441537
- Y. Kuroda, E. Yasugi, H. Aoi, K. Miura and T. Morimoto, J. Chem. Soc., Faraday Trans. I, 84 (1988) 2421.
- (1988) J. Chem. Soc., Faraday Trans. I , vol.84 , pp. 2421
- Kuroda, Y.¹ Yasugi, E.² Aoi, H.³ Miura, K.⁴ Morimoto, T.⁵

43
- 0000016654
- X.D. Peng and M.A. Barteau, Surf. Sci. 233 (1990) 283.
- (1990) Surf. Sci. , vol.233 , pp. 283
- Peng, X.D.¹ Barteau, M.A.²

44
- 0001515593
- H. Onishi, C. Egawa, T. Aruga and Y. Iwasawa, Surf. Sci. 191 (1987) 479.
- (1987) Surf. Sci. , vol.191 , pp. 479
- Onishi, H.¹ Egawa, C.² Aruga, T.³ Iwasawa, Y.⁴

45
- 0002601179
- C. Martin, I. Martin and V. Rives, J. Mol. Catal. 73 (1992) 51.
- (1992) J. Mol. Catal. , vol.73 , pp. 51
- Martin, C.¹ Martin, I.² Rives, V.³

46
- 0029253078
- K. Domen, H. Yamamoto, N. Watanabe, A. Wada and C. Hirose, Appl. Phys. A 60 (1995) 131.
- (1995) Appl. Phys. A , vol.60 , pp. 131
- Domen, K.¹ Yamamoto, H.² Watanabe, N.³ Wada, A.⁴ Hirose, C.⁵

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