SCOPUS 정보 검색 플랫폼

Journal of Chemical Physics

Volumn 132, Issue 2, 2010, Pages

Comparison of hydrogen and deuterium adsorption on Pd(100)

(6) Gladys, M J a Kambali, I a Karolewski, M A b Soon, A c Stampfl, C c O'Connor, D J a

a UNIVERSITY OF NEWCASTLE (Australia)

b UNIVERSITI BRUNEI DARUSSALAM (Brunei Darussalam)

c UNIVERSITY OF SYDNEY (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION SITE; DENSITY FUNCTIONAL THEORY CALCULATIONS; DIFFERENT HEIGHTS; HOLLOW SITES; HYDROGEN ISOTOPE; ION RECOIL; LOW ENERGIES; METAL SURFACES; ROOM TEMPERATURE; ZERO-POINT ENERGIES;

ADSORBATES; DENSITY FUNCTIONAL THEORY; DEUTERIUM; HYDROGEN; NEON; PALLADIUM; SURFACE REACTIONS;

ADSORPTION;

EID: 74549213885 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.3292686 Document Type: Article

Times cited : (18)

References (38)

1
- 57649244456
- 0167-5729,. 10.1016/0167-5729(88)90009-X
- K. Christmann, Surf. Sci. Rep. 0167-5729 9, 1 (1988). 10.1016/0167-5729(88)90009-X
- (1988) Surf. Sci. Rep. , vol.9 , pp. 1
- Christmann, K.¹

2
- 0001931782
- 0079-6816,. 10.1016/0079-6816(95)93412-Z
- K. Christmann, Prog. Surf. Sci. 0079-6816 48, 15 (1995). 10.1016/0079-6816(95)93412-Z
- (1995) Prog. Surf. Sci. , vol.48 , pp. 15
- Christmann, K.¹

3
- 43049143531
- 0169-4332,. 10.1016/j.apsusc.2008.01.037
- I. Kambali, D. J. O'Connor, M. J. Gladys, and M. A. Karolewski, Appl. Surf. Sci. 0169-4332 254, 4245 (2008). 10.1016/j.apsusc.2008.01.037
- (2008) Appl. Surf. Sci. , vol.254 , pp. 4245
- Kambali, I.¹ O'Connor, D.J.² Gladys, M.J.³ Karolewski, M.A.⁴

4
- 37649032662
- 0163-1829,. 10.1103/PhysRevB.69.165418
- M. J. Gladys, F. Samavat, B. V. King, and D. J. O'Connor, Phys. Rev. B 0163-1829 69, 165418 (2004). 10.1103/PhysRevB.69.165418
- (2004) Phys. Rev. B , vol.69 , pp. 165418
- Gladys, M.J.¹ Samavat, F.² King, B.V.³ O'Connor, D.J.⁴

5
- 42449098421
- F. Samavat, M. J. Gladys, C. J. Jenks, T. A. Lograsso, B. V. King, D. J. O'Connor, Surf. Interface Anal. 40, 433 (2008).
- (2008) Surf. Interface Anal. , vol.40 , pp. 433
- Samavat, F.¹ Gladys, M.J.² Jenks, C.J.³ Lograsso, T.A.⁴ King, B.V.⁵ O'Connor, D.J.⁶

6
- 0346083209
- 0039-6028,. 10.1016/S0039-6028(87)81063-4
- F. Besenbacher, I. Stensgard, and K. Mortensen, Surf. Sci. 0039-6028 191, 288 (1987). 10.1016/S0039-6028(87)81063-4
- (1987) Surf. Sci. , vol.191 , pp. 288
- Besenbacher, F.¹ Stensgard, I.² Mortensen, K.³

7
- 0004226517
- 0039-6028,. 10.1016/0039-6028(84)90038-4
- K. H. Rieder and W. Stocker, Surf. Sci. 0039-6028 148, 139 (1984). 10.1016/0039-6028(84)90038-4
- (1984) Surf. Sci. , vol.148 , pp. 139
- Rieder, K.H.¹ Stocker, W.²

8
- 4243813393
- 0031-9007,. 10.1103/PhysRevLett.57.2594
- D. Tománek, S. G. Louie, and C. T. Chan, Phys. Rev. Lett. 0031-9007 57, 2594 (1986). 10.1103/PhysRevLett.57.2594
- (1986) Phys. Rev. Lett. , vol.57 , pp. 2594
- Tománek, D.¹ Louie, S.G.² Chan, C.T.³

9
- 0000929247
- 0163-1829,. 10.1103/PhysRevB.43.4699
- D. Tománek, Z. Sun, and S. G. Louie, Phys. Rev. B 0163-1829 43, 4699 (1991). 10.1103/PhysRevB.43.4699
- (1991) Phys. Rev. B , vol.43 , pp. 4699
- Tománek, D.¹ Sun, Z.² Louie, S.G.³

10
- 0000692049
- 0163-1829,. 10.1103/PhysRevB.50.2548
- S. Wilke, D. Hennig, and R. Lober, Phys. Rev. B 0163-1829 50, 2548 (1994). 10.1103/PhysRevB.50.2548
- (1994) Phys. Rev. B , vol.50 , pp. 2548
- Wilke, S.¹ Hennig, D.² Lober, R.³

11
- 0001400826
- 10.1088/0953-8984/8/41/012
- A. Eichler, J. Hafner and G. Kresse, J. Phys. Condens. Matt. 8, 7659 (1996). 10.1088/0953-8984/8/41/012
- (1996) J. Phys. Condens. Matt. , vol.8 , pp. 7659
- Eichler, A.¹ Hafner, J.² Kresse, G.³

12
- 0032140252
- 0039-6028,. 10.1016/S0039-6028(98)00354-9
- W. Dong, V. Ledentu, Ph. Sautet, A. Eichler, and J. Hafner, Surf. Sci. 0039-6028 411, 123 (1998). 10.1016/S0039-6028(98)00354-9
- (1998) Surf. Sci. , vol.411 , pp. 123
- Dong, W.¹ Ledentu, V.² Sautet, Ph.³ Eichler, A.⁴ Hafner, J.⁵

13
- 0032045452
- 0039-6028,. 10.1016/S0039-6028(98)00020-X
- H. Okuyama, W. Siga, N. Takagi, M. Nishijima, and T. Aruga, Surf. Sci. 0039-6028 401, 344 (1998). 10.1016/S0039-6028(98)00020-X
- (1998) Surf. Sci. , vol.401 , pp. 344
- Okuyama, H.¹ Siga, W.² Takagi, N.³ Nishijima, M.⁴ Aruga, T.⁵

14
- 0027242520
- Low-energy ion scattering at surfaces
- DOI 10.1016/0167-5729(93)90024-J
- H. Niehus, W. Heiland, and E. Taglauer, Surf. Sci. Rep. 0167-5729 17, 213 (1993). 10.1016/0167-5729(93)90024-J (Pubitemid 23653125)
- (1993) Surface Science Reports , vol.17 , Issue.4-5 , pp. 213-303
- Niehus Horst¹ Heiland Werner² Taglauer Edmund³

15
- 0031187201
- 0039-6028,. 10.1016/S0039-6028(97)00131-3
- R. G. Agostino, P. Aebi, J. Osterwalder, J. Hayoz, and L. Schlapbach, Surf. Sci. 0039-6028 384, 36 (1997). 10.1016/S0039-6028(97)00131-3
- (1997) Surf. Sci. , vol.384 , pp. 36
- Agostino, R.G.¹ Aebi, P.² Osterwalder, J.³ Hayoz, J.⁴ Schlapbach, L.⁵

16
- 14744286516
- Kalypso: A software package for molecular dynamics simulation of atomic collisions at surfaces
- DOI 10.1016/j.nimb.2004.12.074, PII S0168583X04013588
- M. A. Karolewski, Nucl. Instrum. Methods Phys. Res. B 0168-583X 230, 402 (2005). 10.1016/j.nimb.2004.12.074 (Pubitemid 40329996)
- (2005) Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms , vol.230 , Issue.1-4 , pp. 402-405
- Karolewski, M.A.¹

17
- 0000473318
- 0163-1829,. 10.1103/PhysRevB.32.6278
- S. H. Overbury and D. R. Huntley, Phys. Rev. B 0163-1829 32, 6278 (1985). 10.1103/PhysRevB.32.6278
- (1985) Phys. Rev. B , vol.32 , pp. 6278
- Overbury, S.H.¹ Huntley, D.R.²

18
- 70349568754
- 0953-8984,. 10.1088/0953-8984/21/39/395502
- P. Giannozzi, S. Baroni, N. Bonini, M. Calandra, R. Car, C. Cavazzoni, D. Ceresoli, G. L. Chiarotti, M. Cococcioni, I. Dabo, A. Dal Corso, S. Fabris, G. Fratesi, S. de Gironcoli, R. Gebauer, U. Gerstmann, C. Gougoussis, A. Kokalj, M. Lazzeri, L. Martin-Samos, N. Marzari, F. Mauri, R. Mazzarello, S. Paolini, A. Pasquarello, L. Paulatto, C. Sbraccia, S. Scandolo, G. Sclauzero, A. P. Seitsonen, A. Smogunov, P. Umari, and R. M. Wentzcovitch, J. Phys.: Condens. Matter 0953-8984 21, 395502 (2009) http://www.quantum-espresso.org/. 10.1088/0953-8984/21/39/395502
- (2009) J. Phys.: Condens. Matter , vol.21 , pp. 395502
- 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 Dal Corso, A.¹¹ Fabris, S.¹² Fratesi, G.¹³ De Gironcoli, S.¹⁴ Gebauer, R.¹⁵ Gerstmann, U.¹⁶ Gougoussis, C.¹⁷ Kokalj, A.¹⁸ Lazzeri, M.¹⁹ Martin-Samos, L.²⁰ more..

19
- 4243943295
- 0031-9007,. 10.1103/PhysRevLett.77.3865
- J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 0031-9007 77, 3865 (1996). 10.1103/PhysRevLett.77.3865
- (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
- Perdew, J.P.¹ Burke, K.² Ernzerhof, M.³

20
- 0000258831
- 2 molecule: Using the PBE functional, the bondlength is 2.688 Å (exp. 2.648 Å and other DFT PBE calculations yield 2.679 Å) The binding energy is 2.268 eV/H atom and the experimental value is 2.363 eV/H, while the corresponding PBE value from the literature is, for example, 2.277 eV/H atom (Ref.)
- 2 molecule: using the PBE functional, the bondlength is 2.688 Å (exp. 2.648 Å and other DFT PBE calculations yield 2.679 Å) [Phys. Rev. B 55, 7454-7459 (1997)]. The binding energy is 2.268 eV/H atom and the experimental value is 2.363 eV/H, while the corresponding PBE value from the literature is, for example, 2.277 eV/H atom (Ref.).
- (1997) Phys. Rev. B , vol.55 , pp. 7454-7459

21
- 84999510572
- 0039-6028,. 10.1016/0039-6028(80)90396-9
- R. J. Behm, K. Christmann, and G. Ertl, Surf. Sci. 0039-6028 99, 320 (1980). 10.1016/0039-6028(80)90396-9
- (1980) Surf. Sci. , vol.99 , pp. 320
- Behm, R.J.¹ Christmann, K.² Ertl, G.³

22
- 0027115150
- State specific velocity distribution of hydrogen isotopes desorbing from Pd(100)
- DOI 10.1016/0039-6028(92)91443-F
- L. Schröter, Chr. Trame, R. David, and H. Zacharias, Surf. Sci. 0039-6028 272, 229 (1992). 10.1016/0039-6028(92)91443-F (Pubitemid 23627722)
- (1992) Surface Science , vol.272 , Issue.1-3 , pp. 229-234
- Schroeter, L.¹ Trame, Chr.² David, R.³ Zacharias, H.⁴

23
- 0242314577
- 0039-6028,. 10.1016/S0039-6028(87)80036-5
- D. R. Mullins, B. Roop, S. A. Costello, and J. M. White, Surf. Sci. 0039-6028 186, 67 (1987). 10.1016/S0039-6028(87)80036-5
- (1987) Surf. Sci. , vol.186 , pp. 67
- Mullins, D.R.¹ Roop, B.² Costello, S.A.³ White, J.M.⁴

24
- 0000671263
- 0163-1829,. 10.1103/PhysRevB.57.2493
- A. Gross and M. Scheffler, Phys. Rev. B 0163-1829 57, 2493 (1998). 10.1103/PhysRevB.57.2493
- (1998) Phys. Rev. B , vol.57 , pp. 2493
- Gross, A.¹ Scheffler, M.²

25
- 0042754506
- 0039-6028,. 10.1016/0039-6028(90)90398-R
- T. L. Einstein, M. S. Daw, and S. M. Foiles, Surf. Sci. 0039-6028 227, 114 (1990). 10.1016/0039-6028(90)90398-R
- (1990) Surf. Sci. , vol.227 , pp. 114
- Einstein, T.L.¹ Daw, M.S.² Foiles, S.M.³

26
- 0001202902
- 0022-3654,. 10.1021/j100362a017
- T. N. Truong, D. G. Truhlar, and B. C. Garrett, J. Phys. Chem. 0022-3654 93, 8227 (1989). 10.1021/j100362a017
- (1989) J. Phys. Chem. , vol.93 , pp. 8227
- Truong, T.N.¹ Truhlar, D.G.² Garrett, B.C.³

27
- 0000970896
- 0039-6028,. 10.1016/0039-6028(85)90766-6
- J. G. Lauderdale and D. G. Truhlar, Surf. Sci. 0039-6028 164, 558 (1985). 10.1016/0039-6028(85)90766-6
- (1985) Surf. Sci. , vol.164 , pp. 558
- Lauderdale, J.G.¹ Truhlar, D.G.²

28
- 0942290097
- 0021-9606,. 10.1063/1.1628220
- W. Zheng and A. Tadjeddine, J. Chem. Phys. 0021-9606 119, 13096 (2003). 10.1063/1.1628220
- (2003) J. Chem. Phys. , vol.119 , pp. 13096
- Zheng, W.¹ Tadjeddine, A.²

29
- 4244065424
- 0031-9007,. 10.1103/PhysRevLett.50.1680
- C. Nyberg and C. G. Tengstl, Phys. Rev. Lett. 0031-9007 50, 1680 (1983). 10.1103/PhysRevLett.50.1680
- (1983) Phys. Rev. Lett. , vol.50 , pp. 1680
- Nyberg, C.¹ Tengstl, C.G.²

30
- 0031482645
- 0002-9505,. 10.1119/1.18747
- R. W. Robinett, Am. J. Phys. 0002-9505 65, 190 (1997). 10.1119/1.18747
- (1997) Am. J. Phys. , vol.65 , pp. 190
- Robinett, R.W.¹

31
- 0003998388
- 88th ed. (CRC, Boca Raton)
- D. R. Lide, CRC Handbook of Chemistry and Physics: A Ready Reference Book of Chemical and Physical Data, 88th ed. (CRC, Boca Raton, 2008).
- (2008) CRC Handbook of Chemistry and Physics: A Ready Reference Book of Chemical and Physical Data
- Lide, D.R.¹

32
- 84954358504
- 0039-6028,. 10.1016/j.susc.2008.09.031
- M. J. Gladys, A. Mikkelsen, J. N. Andersen, and G. Held, Surf. Sci. 0039-6028 602, 3540 (2008). 10.1016/j.susc.2008.09.031
- (2008) Surf. Sci. , vol.602 , pp. 3540
- Gladys, M.J.¹ Mikkelsen, A.² Andersen, J.N.³ Held, G.⁴

33
- 67249164853
- 0167-5729. 10.1016/j.surfre2009.07.001
- A. Hodgson and S. Haq, Surf. Sci. Rep. 0167-5729 64 381 (2009). 10.1016/j.surfrep.2009.07.001
- (2009) Surf. Sci. Rep. , vol.64 , pp. 381
- Hodgson, A.¹ Haq, S.²

34
- 0027640853
- Coverage-dependent DLEED analysis of the adsorption structure of K on Ni(100)
- DOI 10.1016/0039-6028(93)90242-C
- H. Wedler, M. A. Mendez, P. Bayer, U. Loffler, K. Heinz, V. Fritsche, and J. B. Pendry, Surf. Sci. 0039-6028 293, 47 (1993). 10.1016/0039-6028(93)90242-C (Pubitemid 23696996)
- (1993) Surface Science , vol.293 , Issue.1-2 , pp. 47-56
- Wedler, H.¹ Mendez, M.A.² Bayer, P.³ Loeffler, U.⁴ Heinz, K.⁵ Fritzsche, V.⁶ Pendry, J.B.⁷

35
- 51749122386
- 0163-1829,. 10.1103/PhysRevB.78.115411
- M. Wilde and K. Fukutani, Phys. Rev. B 0163-1829 78, 115411 (2008). 10.1103/PhysRevB.78.115411
- (2008) Phys. Rev. B , vol.78 , pp. 115411
- Wilde, M.¹ Fukutani, K.²

36
- 0001339048
- 1089-5647,. 10.1021/jp9904769
- H. Okuyama, T. Nakagawa, W. Siga, N. Takagi, M. Nishijima, and T. Aruga, J. Phys. Chem. B 1089-5647 103, 7876 (1999). 10.1021/jp9904769
- (1999) J. Phys. Chem. B , vol.103 , pp. 7876
- Okuyama, H.¹ Nakagawa, T.² Siga, W.³ Takagi, N.⁴ Nishijima, M.⁵ Aruga, T.⁶

37
- 0035919005
- Depth-resolved analysis of subsurface hydrogen absorbed by Pd(1 0 0)
- DOI 10.1016/S0039-6028(01)00727-0, PII S0039602801007270
- M. Wilde, M. Matsumoto, K. Fukutani, and T. Aruga, Surf. Sci. 0039-6028 482-485, 346 (2001). 10.1016/S0039-6028(01)00727-0 (Pubitemid 32615642)
- (2001) Surface Science , vol.482-485 , Issue.PART 1 , pp. 346-352
- Wilde, M.¹ Matsumoto, M.² Fukutani, K.³ Aruga, T.⁴

38
- 0003847219
- (Springer, Berlin), 10.1007/BFb0103398
- H. Wipf, Hydrogen in Metals III, Topics in Applied Physics (Springer, Berlin, 1997), Vol. 73. 10.1007/BFb0103398
- (1997) Hydrogen in Metals III, Topics in Applied Physics , vol.73
- Wipf, H.¹

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.