SCOPUS 정보 검색 플랫폼

Physical Review B - Condensed Matter and Materials Physics

Volumn 77, Issue 20, 2008, Pages

Nature and strength of bonding in a crystal of semiconducting nanotubes: Van der Waals density functional calculations and analytical results

(3) Kleis, Jesper a,b Schröder, Elsebeth a Hyldgaard, Per a

a CHALMERS UNIVERSITY OF TECHNOLOGY (Sweden)

b TECHNICAL UNIVERSITY OF DENMARK (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 43949107189 PISSN: 10980121 EISSN: 1550235X Source Type: Journal
DOI: 10.1103/PhysRevB.77.205422 Document Type: Article

Times cited : (56)

References (79)

1
- 0003790413
- Springer-Verlag, Berlin
- M. S. Dresselhaus, G. Dresselhaus, and Ph. Avouris, Carbon Nanotubes, Synthesis, Structure, Properties, and Applications (Springer-Verlag, Berlin, 2001).
- (2001) Carbon Nanotubes, Synthesis, Structure, Properties, and Applications
- Dresselhaus, M.S.¹ Dresselhaus, G.² Avouris, Ph.³

2
- 3242834384
- NATUAS 0028-0836 10.1038/381678a0
- M. M. Treacy, T. Ebbesen, and J. M. Gibson, Nature (London) NATUAS 0028-0836 10.1038/381678a0 381, 678 (1996)
- (1996) Nature (London) , vol.381 , pp. 678
- Treacy, M.M.¹ Ebbesen, T.² Gibson, J.M.³

3
- 0346755376
- PRLTAO 0031-9007 10.1103/PhysRevLett.79.1297
- J. P. Lu, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.79.1297 79, 1297 (1997).
- (1997) Phys. Rev. Lett. , vol.79 , pp. 1297
- Lu, J.P.¹

4
- 0035843889
- SCIEAS 0036-8075 10.1126/science.1057823
- R. R. Schlittler, J. W. Seo, J. K. Gimzewski, C. Durkan, M. S. Saifullah, and M. E. Welland, Science SCIEAS 0036-8075 10.1126/science.1057823 292, 1136 (2001).
- (2001) Science , vol.292 , pp. 1136
- Schlittler, R.R.¹ Seo, J.W.² Gimzewski, J.K.³ Durkan, C.⁴ Saifullah, M.S.⁵ Welland, M.E.⁶

5
- 0342819025
- NATUAS 0028-0836 10.1038/354056a0
- S. Iijima, Nature (London) NATUAS 0028-0836 10.1038/354056a0 354, 56 (1991).
- (1991) Nature (London) , vol.354 , pp. 56
- Iijima, S.¹

6
- 0027609801
- JCRGAE 0022-0248 10.1016/0022-0248(93)90522-X
- X. F. Zhang, X. B. Zhang, G. Van Tendeloo, S. Amelinckx, M. Op de Beeck, and J. Van Landuyt, J. Cryst. Growth JCRGAE 0022-0248 10.1016/0022-0248(93) 90522-X 130, 368 (1993).
- (1993) J. Cryst. Growth , vol.130 , pp. 368
- Zhang, X.F.¹ Zhang, X.B.² Van Tendeloo, G.³ Amelinckx, S.⁴ Op De Beeck, M.⁵ Van Landuyt, J.⁶

7
- 0030849611
- NATUAS 0028-0836 10.1038/40369
- M. Terrones, N. Grobert, J. Olivares, J. P. Zhang, H. Terrones, K. Kordatos, W. K. Hsu, J. P. Hare, P. D. Townsend, K. Prassides, A. K. Cheetham, H. W. Kroto, and D. R. M. Walton, Nature (London) NATUAS 0028-0836 10.1038/40369 388, 52 (1997).
- (1997) Nature (London) , vol.388 , pp. 52
- Terrones, M.¹ Grobert, N.² Olivares, J.³ Zhang, J.P.⁴ Terrones, H.⁵ Kordatos, K.⁶ Hsu, W.K.⁷ Hare, J.P.⁸ Townsend, P.D.⁹ Prassides, K.¹⁰ Cheetham, A.K.¹¹ Kroto, H.W.¹² Walton, D.R.M.¹³

8
- 0001132276
- PRLTAO 0031-9007 10.1103/PhysRevLett.81.1869
- C.-H. Kiang, M. Endo, P. M. Ajayan, G. Dresselhaus, and M. S. Dresselhaus, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.81.1869 81, 1869 (1998).
- (1998) Phys. Rev. Lett. , vol.81 , pp. 1869
- Kiang, C.-H.¹ Endo, M.² Ajayan, P.M.³ Dresselhaus, G.⁴ Dresselhaus, M.S.⁵

9
- 1842586863
- SCIEAS 0036-8075 10.1126/science.1094982
- Y.-L. Li, I. Kinloch, and A. H. Windle, Science SCIEAS 0036-8075 10.1126/science.1094982 304, 276 (2004).
- (2004) Science , vol.304 , pp. 276
- Li, Y.-L.¹ Kinloch, I.² Windle, A.H.³

10
- 8844232743
- SCIEAS 0036-8075 10.1126/science.1104276
- M. Zhang, K. R. Atkinson, and R. H. Baughman, Science SCIEAS 0036-8075 10.1126/science.1104276 306, 1358 (2004).
- (2004) Science , vol.306 , pp. 1358
- Zhang, M.¹ Atkinson, K.R.² Baughman, R.H.³

11
- 4444249427
- SCIEAS 0036-8075 10.1126/science.1101398
- L. M. Ericson, Science SCIEAS 0036-8075 10.1126/science.1101398 305, 1447 (2004).
- (2004) Science , vol.305 , pp. 1447
- Ericson, L.M.¹

12
- 0034668521
- PRBMDO 0163-1829 10.1103/PhysRevB.62.R13310
- J. Hwang, H. H. Gommans, A. Ugawa, H. Tashiro, R. Haggenmueller, K. I. Winey, J. E. Fischer, D. B. Tanner, and A. G. Rinzler, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.62.R13310 62, R13310 (2000).
- (2000) Phys. Rev. B , vol.62 , pp. 13310
- Hwang, J.¹ Gommans, H.H.² Ugawa, A.³ Tashiro, H.⁴ Haggenmueller, R.⁵ Winey, K.I.⁶ Fischer, J.E.⁷ Tanner, D.B.⁸ Rinzler, A.G.⁹

13
- 9644267243
- PRLTAO 0031-9007 10.1103/PhysRevLett.72.1878
- X. Blase, L. X. Benedict, E. L. Shirley, and S. G. Louie, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.72.1878 72, 1878 (1994)
- (1994) Phys. Rev. Lett. , vol.72 , pp. 1878
- Blase, X.¹ Benedict, L.X.² Shirley, E.L.³ Louie, S.G.⁴

14
- 0000273759
- PRBMDO 0163-1829 10.1103/PhysRevB.59.12678
- D. Sánchez-Portal, E. Artacho, J. M. Soler, A. Rubio, and P. Ordejón, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.12678 59, 12678 (1999).
- (1999) Phys. Rev. B , vol.59 , pp. 12678
- Sánchez-Portal, D.¹ Artacho, E.² Soler, J.M.³ Rubio, A.⁴ Ordejón, P.⁵

15
- 10844298023
- See, for example, JCPSA6 0021-9606 10.1063/1.1810132
- See, for example, V. Barone and G. E. Scuseria, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1810132 121, 10376 (2004).
- (2004) J. Chem. Phys. , vol.121 , pp. 10376
- Barone, V.¹ Scuseria, G.E.²

16
- 26144450583
- For example, in the parametrization, PRBMDO 0163-1829 10.1103/PhysRevB.23.5048
- For example, in the parametrization, J. P. Perdew and A. Zunger, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.23.5048 23, 5048 (1981).
- (1981) Phys. Rev. B , vol.23 , pp. 5048
- Perdew, J.P.¹ Zunger, A.²

17
- 4243943295
- PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865
- J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865 77, 3865 (1996).
- (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
- Perdew, J.P.¹ Burke, K.² Ernzerhof, M.³

18
- 1542303722
- NMAACR 1476-1122 10.1038/nmat1076
- A. Kis, G. Csányi, J.-P. Salvetat, T.-N. Lee, E. Couteau, A. J. Kulik, W. Benoit, J. Brugger, and L. Ferró, Nat. Mater. NMAACR 1476-1122 10.1038/nmat1076 3, 153 (2004).
- (2004) Nat. Mater. , vol.3 , pp. 153
- Kis, A.¹ Csányi, G.² Salvetat, J.-P.³ Lee, T.-N.⁴ Couteau, E.⁵ Kulik, A.J.⁶ Benoit, W.⁷ Brugger, J.⁸ Ferró, L.⁹

19
- 0035936305
- For a description of corresponding LDA problems in providing a transferable description for polymer crystals, please see JCPSA6 0021-9606 10.1063/1.1420404
- For a description of corresponding LDA problems in providing a transferable description for polymer crystals, please see M. S. Miao, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1420404 115, 11317 (2001).
- (2001) J. Chem. Phys. , vol.115 , pp. 11317
- Miao, M.S.¹

20
- 4243476736
- CHPLBC 0009-2614 10.1016/0009-2614(94)01402-H
- J. M. Pérez-Jordá and A. D. Becke, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(94)01402-H 233, 134 (1995).
- (1995) Chem. Phys. Lett. , vol.233 , pp. 134
- Pérez-Jordá, J.M.¹ Becke, A.D.²

21
- 12944252320
- 0039-6028
- H. Rydberg, N. Jacobson, P. Hyldgaard, S. I. Simak, B. I. Lundqvist, and D. C. Langreth, Surf. Sci. 532-535, 606 (2003). 0039-6028
- (2003) Surf. Sci. , vol.532-535 , pp. 606
- Rydberg, H.¹ Jacobson, N.² Hyldgaard, P.³ Simak, S.I.⁴ Lundqvist, B.I.⁵ Langreth, D.C.⁶

22
- 0142219835
- PRLTAO 0031-9007 10.1103/PhysRevLett.91.126402
- H. Rydberg, M. Dion, N. Jacobson, E. Schröder, P. Hyldgaard, S. I. Simak, D. C. Langreth, and B. I. Lundqvist, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.91.126402 91, 126402 (2003).
- (2003) Phys. Rev. Lett. , vol.91 , pp. 126402
- Rydberg, H.¹ Dion, M.² Jacobson, N.³ Schröder, E.⁴ Hyldgaard, P.⁵ Simak, S.I.⁶ Langreth, D.C.⁷ Lundqvist, B.I.⁸

23
- 35448973258
- PRBMDO 0163-1829 10.1103/PhysRevB.76.155425
- E. Ziambaras, J. Kleis, E. Schröder, and P. Hyldgaard, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.76.155425 76, 155425 (2007).
- (2007) Phys. Rev. B , vol.76 , pp. 155425
- Ziambaras, E.¹ Kleis, J.² Schröder, E.³ Hyldgaard, P.⁴

24
- 3242718844
- PRLTAO 0031-9007 10.1103/PhysRevLett.92.246401
- M. Dion, H. Rydberg, E. Schröder, D.C. Langreth, and B.I. Lundqvist, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.92.246401 92, 246401 (2004)
- (2004) Phys. Rev. Lett. , vol.92 , pp. 246401
- Dion, M.¹ Rydberg, H.² Schröder, E.³ Langreth, D.C.⁴ Lundqvist, B.I.⁵

25
- 27144546424
- PRLTAO 0031-9007 10.1103/PhysRevLett.95.109902
- M. Dion, H. Rydberg, E. Schröder, D.C. Langreth, and B.I. Lundqvist, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.95.109902 95 109902 (E) (2005).
- (2005) Phys. Rev. Lett. , vol.95 , pp. 109902
- Dion, M.¹ Rydberg, H.² Schröder, E.³ Langreth, D.C.⁴ Lundqvist, B.I.⁵

26
- 34648834821
- PRBMDO 0163-1829 10.1103/PhysRevB.76.125112
- T. Thonhauser, V. R. Cooper, S. Li, A. Puzder, P. Hyldgaard, and D. C. Langreth, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.76.125112 76, 125112 (2007).
- (2007) Phys. Rev. B , vol.76 , pp. 125112
- Thonhauser, T.¹ Cooper, V.R.² Li, S.³ Puzder, A.⁴ Hyldgaard, P.⁵ Langreth, D.C.⁶

27
- 34548747420
- PRBMDO 0163-1829 10.1103/PhysRevB.76.100201
- J. Kleis, B. I. Lundqvist, D. C. Langreth, and E. Schröder, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.76.100201 76, 100201 (R) (2007).
- (2007) Phys. Rev. B , vol.76 , pp. 100201
- Kleis, J.¹ Lundqvist, B.I.² Langreth, D.C.³ Schröder, E.⁴

28
- 0000412738
- See, for example, JPYBAN 0360-6384 10.1002/pol.1975.130130607
- See, for example, G. Avitabile, J. Polym. Sci., Polym. Lett. Ed. JPYBAN 0360-6384 10.1002/pol.1975.130130607 13, 351 (1975).
- (1975) J. Polym. Sci., Polym. Lett. Ed. , vol.13 , pp. 351
- Avitabile, G.¹

29
- 38649139343
- JACSAT 0002-7863 10.1021/ja0761941
- V. R. Cooper, T. Thonhauser, A. Puzder, E. Schröder, B. I. Lundqvist, and D. C. Langreth, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja0761941 130, 1304 (2008)
- (2008) J. Am. Chem. Soc. , vol.130 , pp. 1304
- Cooper, V.R.¹ Thonhauser, T.² Puzder, A.³ Schröder, E.⁴ Lundqvist, B.I.⁵ Langreth, D.C.⁶

30
- 34547139114
- JCPSA6 0021-9606 10.1063/1.2189229
- A. Puzder, M. Dion, and D. C. Langreth, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2189229 124, 164105 (2006)
- (2006) J. Chem. Phys. , vol.124 , pp. 164105
- Puzder, A.¹ Dion, M.² Langreth, D.C.³

31
- 34547237014
- JCPSA6 0021-9606 10.1063/1.2189230
- T. Thonhauser, A. Puzder, and D. C. Langreth, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2189230 124, 164106 (2006).
- (2006) J. Chem. Phys. , vol.124 , pp. 164106
- Thonhauser, T.¹ Puzder, A.² Langreth, D.C.³

32
- 43949103926
- A quick set of DFT-GGA calculations produce an extremely shallow binding indication at much too large distances and representing only 5% of the presently report vdW-DF binding.
- A quick set of DFT-GGA calculations produce an extremely shallow binding indication at much too large distances and representing only 5% of the presently report vdW-DF binding.

33
- 84956244774
- EULEEJ 0295-5075 10.1209/0295-5075/29/1/008
- J.-C. Charlier, X. Gonze, and J.-P. Michenaud, Europhys. Lett. EULEEJ 0295-5075 10.1209/0295-5075/29/1/008 29, 43 (1995)
- (1995) Europhys. Lett. , vol.29 , pp. 43
- Charlier, J.-C.¹ Gonze, X.² Michenaud, J.-P.³

34
- 0037089297
- PRBMDO 0163-1829 10.1103/PhysRevB.65.155411
- S. Reich, C. Thomsen, and P. Ordejón, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.155411 65, 155411 (2002).
- (2002) Phys. Rev. B , vol.65 , pp. 155411
- Reich, S.¹ Thomsen, C.² Ordejón, P.³

35
- 42749102313
- PRBMDO 0163-1829 10.1103/PhysRevB.69.155406
- R. Zacharia, H. Ulbricht, and T. Hertel, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.69.155406 69, 155406 (2004).
- (2004) Phys. Rev. B , vol.69 , pp. 155406
- Zacharia, R.¹ Ulbricht, H.² Hertel, T.³

36
- 3743107459
- JCPSA6 0021-9606 10.1063/1.471545
- J. Q. Sun and R. J. Bartlett, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.471545 104, 8553 (1996)
- (1996) J. Chem. Phys. , vol.104 , pp. 8553
- Sun, J.Q.¹ Bartlett, R.J.²

37
- 0032529890
- JCPSA6 0021-9606 10.1063/1.477020
- S. Hirata and S. Iwata, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.477020 109, 4147 (1998)
- (1998) J. Chem. Phys. , vol.109 , pp. 4147
- Hirata, S.¹ Iwata, S.²

38
- 26344476922
- PRBMDO 0163-1829 10.1103/PhysRevB.27.3506
- S. Suhai, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.27.3506 27, 3506 (1983).
- (1983) Phys. Rev. B , vol.27 , pp. 3506
- Suhai, S.¹

39
- 0000277432
- JCPSA6 0021-9606 10.1063/1.478256
- P. Y. Ayala and G. E. Scuseria, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.478256 110, 3660 (1999).
- (1999) J. Chem. Phys. , vol.110 , pp. 3660
- Ayala, P.Y.¹ Scuseria, G.E.²

40
- 0035581275
- JCPSA6 0021-9606 10.1063/1.1414369
- P. Y. Ayala, K. N. Kudin, and G. E. Scuseria, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1414369 115, 9698 (2001).
- (2001) J. Chem. Phys. , vol.115 , pp. 9698
- Ayala, P.Y.¹ Kudin, K.N.² Scuseria, G.E.³

41
- 33645835183
- PRLTAO 0031-9007 10.1103/PhysRevLett.96.146107
- S. D. Chakarova-Käck, E. Schröder, B. I. Lundqvist, and D. C. Langreth, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.96.146107 96, 146107 (2006).
- (2006) Phys. Rev. Lett. , vol.96 , pp. 146107
- Chakarova-Käck, S.D.¹ Schröder, E.² Lundqvist, B.I.³ Langreth, D.C.⁴

42
- 33749441470
- PRBMDO 0163-1829 10.1103/PhysRevB.74.155402
- S. D. Chakarova-Käck, Ø. Borck, E. Schröder, and B. I. Lundqvist, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.74.155402 74, 155402 (2006).
- (2006) Phys. Rev. B , vol.74 , pp. 155402
- Chakarova-Käck, S.D.¹ Borck Ø² Schröder, E.³ Lundqvist, B.I.⁴

43
- 43949114048
- A parallel project investigates the adhesion of graphite on SiC in a surface unit cell that has the graphite-sheet overlayer relaxed to 2% strain;
- A parallel project investigates the adhesion of graphite on SiC in a surface unit cell that has the graphite-sheet overlayer relaxed to 2% strain; E. Ziambaras, C. Ruberto, B. I. Lundqvist, and P. Hyldgaard (unpublished).
- Ziambaras, E.¹ Ruberto, C.² Lundqvist, B.I.³ Hyldgaard, P.⁴

44
- 0000931982
- ZETFA7 0044-4510
- Y. U. Barash, and O. I. Notysh, Zh. Eksp. Teor. Fiz. ZETFA7 0044-4510 98, 542 (1990).
- (1990) Zh. Eksp. Teor. Fiz. , vol.98 , pp. 542
- Barash, Y.U.¹ Notysh, O.I.²

45
- 0000800996
- PRBMDO 0163-1829 10.1103/PhysRevB.57.6592
- B. E. Sernelius and P. Björk, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.57.6592 57, 6592 (1998).
- (1998) Phys. Rev. B , vol.57 , pp. 6592
- Sernelius, B.E.¹ Björk, P.²

46
- 0001407903
- PRBMDO 0163-1829 10.1103/PhysRevB.61.2204
- M. Boström and B. E. Sernelius, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.61.2204 61, 2204 (2000).
- (2000) Phys. Rev. B , vol.61 , pp. 2204
- Boström, M.¹ Sernelius, B.E.²

47
- 33644553465
- PRLTAO 0031-9007 10.1103/PhysRevLett.96.073201
- J. F. Dobson, A. White, and A. Rubio, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.96.073201 96, 073201 (2006).
- (2006) Phys. Rev. Lett. , vol.96 , pp. 073201
- Dobson, J.F.¹ White, A.² Rubio, A.³

48
- 0037799868
- SUSCAS 0039-6028 10.1016/S0039-6028(03)00238-3
- E. Schröder and P. Hyldgaard, Surf. Sci. SUSCAS 0039-6028 10.1016/S0039-6028(03)00238-3 532, 880 (2003).
- (2003) Surf. Sci. , vol.532 , pp. 880
- Schröder, E.¹ Hyldgaard, P.²

49
- 14644408148
- CMMSEM 0927-0256 10.1016/j.commatsci.2004.12.036
- J. Kleis, P. Hyldgaard, and E. Schröder, Comput. Mater. Sci. CMMSEM 0927-0256 10.1016/j.commatsci.2004.12.036 33, 192 (2005).
- (2005) Comput. Mater. Sci. , vol.33 , pp. 192
- Kleis, J.¹ Hyldgaard, P.² Schröder, E.³

50
- 43949113481
- DACAPO from
- DACAPO from http://wiki.fysik.dtu.dk/dacapo/

51
- 0034664530
- PRBMDO 0163-1829 10.1103/PhysRevB.62.6997
- H. Rydberg, B. I. Lundqvist, D. C. Langreth, and M. Dion, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.62.6997 62, 6997 (2000).
- (2000) Phys. Rev. B , vol.62 , pp. 6997
- Rydberg, H.¹ Lundqvist, B.I.² Langreth, D.C.³ Dion, M.⁴

52
- 13944261578
- IJQCB2 0020-7608 10.1002/qua.20315
- D. C. Langreth, M. Dion, H. Rydberg, E. Schröder, P. Hyldgaard, and B. I. Lundqvist, Int. J. Quantum Chem. IJQCB2 0020-7608 10.1002/qua.20315 101, 599 (2005).
- (2005) Int. J. Quantum Chem. , vol.101 , pp. 599
- Langreth, D.C.¹ Dion, M.² Rydberg, H.³ Schröder, E.⁴ Hyldgaard, P.⁵ Lundqvist, B.I.⁶

53
- 0000790755
- PRLTAO 0031-9007 10.1103/PhysRevLett.80.4153
- W. Kohn, Y. Meir, and D. E. Makarov, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.80.4153 80, 4153 (1998).
- (1998) Phys. Rev. Lett. , vol.80 , pp. 4153
- Kohn, W.¹ Meir, Y.² Makarov, D.E.³

54
- 0000195497
- PRBMDO 0163-1829 10.1103/PhysRevB.59.10461
- S. Kurth and J. P. Perdew, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.10461 59, 10461 (1999).
- (1999) Phys. Rev. B , vol.59 , pp. 10461
- Kurth, S.¹ Perdew, J.P.²

55
- 0001401905
- PRLTAO 0031-9007 10.1103/PhysRevLett.82.2123
- J. F. Dobson and J. Wang, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.82.2123 82, 2123 (1999)
- (1999) Phys. Rev. Lett. , vol.82 , pp. 2123
- Dobson, J.F.¹ Wang, J.²

56
- 0034666973
- PRBMDO 0163-1829 10.1103/PhysRevB.62.10038
- J. F. Dobson and J. Wang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.62.10038 62, 10038 (2000)
- (2000) Phys. Rev. B , vol.62 , pp. 10038
- Dobson, J.F.¹ Wang, J.²

57
- 0000352612
- PRLTAO 0031-9007 10.1103/PhysRevLett.76.1780
- J. F. Dobson and B. P. Dinte, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.76.1780 76, 1780 (1996).
- (1996) Phys. Rev. Lett. , vol.76 , pp. 1780
- Dobson, J.F.¹ Dinte, B.P.²

58
- 0037438539
- PRBMDO 0163-1829 10.1103/PhysRevB.67.045101
- J. M. Pitarke and J. P. Perdew, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.67.045101 67, 045101 (2003).
- (2003) Phys. Rev. B , vol.67 , pp. 045101
- Pitarke, J.M.¹ Perdew, J.P.²

59
- 42749106254
- For illustrations of applications to model, molecular, and/or solid systems, see, for example, PRBMDO 0163-1829 10.1103/PhysRevB.70.205107
- For illustrations of applications to model, molecular, and/or solid systems, see, for example, J. Jung, P. Garcia-Gonzalez, J. F. Dobson, and R. W. Godby, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.70.205107 70, 205107 (2004)
- (2004) Phys. Rev. B , vol.70 , pp. 205107
- Jung, J.¹ Garcia-Gonzalez, P.² Dobson, J.F.³ Godby, R.W.⁴

60
- 21244505043
- JCPSA6 0021-9606 10.1063/1.1884112
- F. Furche and T. Voorhis, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1884112 122, 164106 (2005)
- (2005) J. Chem. Phys. , vol.122 , pp. 164106
- Furche, F.¹ Voorhis, T.²

61
- 0037096494
- PRBMDO 0163-1829 10.1103/PhysRevB.65.235109
- M. Fuchs and X. Gonze, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65. 235109 65, 235109 (2002)
- (2002) Phys. Rev. B , vol.65 , pp. 235109
- Fuchs, M.¹ Gonze, X.²

62
- 0037934417
- PRLTAO 0031-9007 10.1103/PhysRevLett.90.189701
- M. Fuchs, K. Burke, Y.-M. Niquet, and X. Gonze, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.90.189701 90, 189701 (2003)
- (2003) Phys. Rev. Lett. , vol.90 , pp. 189701
- Fuchs, M.¹ Burke, K.² Niquet, Y.-M.³ Gonze, X.⁴

63
- 0037156911
- PRLTAO 0031-9007 10.1103/PhysRevLett.88.166401
- F. Aryasetiawan, T. Miyake, and K. Terakura, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.88.166401 88, 166401 (2002)
- (2002) Phys. Rev. Lett. , vol.88 , pp. 166401
- Aryasetiawan, F.¹ Miyake, T.² Terakura, K.³

64
- 0037116039
- PRBMDO 0163-1829 10.1103/PhysRevB.66.245103
- T. Miyake, F. Aryasetiawan, T. Kotani, M. van Schilfgaarde, M. Usuda, and K. Terakura, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.66.245103 66, 245103 (2002)
- (2002) Phys. Rev. B , vol.66 , pp. 245103
- Miyake, T.¹ Aryasetiawan, F.² Kotani, T.³ Van Schilfgaarde, M.⁴ Usuda, M.⁵ Terakura, K.⁶

65
- 33645680431
- PRLTAO 0031-9007 10.1103/PhysRevLett.96.136404
- A. Marini, P. Garcia-Gonzalez, and A. Rubio, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.96.136404 96, 136404 (2006).
- (2006) Phys. Rev. Lett. , vol.96 , pp. 136404
- Marini, A.¹ Garcia-Gonzalez, P.² Rubio, A.³

66
- 0345550323
- MSCEEE 0928-4931 10.1016/j.msec.2003.09.116
- E. Schröder and P. Hyldgaard, Mater. Sci. Eng., C MSCEEE 0928-4931 10.1016/j.msec.2003.09.116 23, 721 (2003).
- (2003) Mater. Sci. Eng., C , vol.23 , pp. 721
- Schröder, E.¹ Hyldgaard, P.²

67
- 19744370244
- CRBNAH 0008-6223 10.1016/j.carbon.2005.01.027
- C. Amovilli and N. H. March, Carbon CRBNAH 0008-6223 10.1016/j.carbon. 2005.01.027 43, 1634 (2005).
- (2005) Carbon , vol.43 , pp. 1634
- Amovilli, C.¹ March, N.H.²

68
- 1842816907
- PLRBAQ 0556-2805 10.1103/PhysRevB.13.5188
- H. J. Monkhorst and J. D. Pack, Phys. Rev. B PLRBAQ 0556-2805 10.1103/PhysRevB.13.5188 13, 5188 (1976).
- (1976) Phys. Rev. B , vol.13 , pp. 5188
- Monkhorst, H.J.¹ Pack, J.D.²

69
- 0242707295
- AQCHA9 0065-3276 10.1016/S0065-3276(08)60597-3
- D. C. Langreth and S. H. Vosko, Adv. Quantum Chem. AQCHA9 0065-3276 10.1016/S0065-3276(08)60597-3 21, 175 (1990).
- (1990) Adv. Quantum Chem. , vol.21 , pp. 175
- Langreth, D.C.¹ Vosko, S.H.²

70
- 85029400214
- PRLTAO 0031-9007 10.1103/PhysRevLett.80.890
- Y. Zhang and W. Yang, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.80.890 80, 890 (1998).
- (1998) Phys. Rev. Lett. , vol.80 , pp. 890
- Zhang, Y.¹ Yang, W.²

71
- 0035891306
- JCPSA6 0021-9606 10.1063/1.1412004
- X. Wu, M. C. Vargas, S. Nayak, V. Lotrich, and G. Scoles, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1412004 115, 8748 (2001).
- (2001) J. Chem. Phys. , vol.115 , pp. 8748
- Wu, X.¹ Vargas, M.C.² Nayak, S.³ Lotrich, V.⁴ Scoles, G.⁵

72
- 84981643136
- IJQCB2 0020-7608 10.1002/qua.560560410
- B. I. Lundqvist, Y. Andersson, H. Shao, S. Chan, and D. C. Langreth, Int. J. Quantum Chem. IJQCB2 0020-7608 10.1002/qua.560560410 56, 247 (1995).
- (1995) Int. J. Quantum Chem. , vol.56 , pp. 247
- Lundqvist, B.I.¹ Andersson, Y.² Shao, H.³ Chan, S.⁴ Langreth, D.C.⁵

73
- 26744451143
- See, for example, PLRBAQ 0556-2805 10.1103/PhysRevB.13.2270
- See, for example, E. Zaremba and W. Kohn, Phys. Rev. B PLRBAQ 0556-2805 10.1103/PhysRevB.13.2270 13, 2270 (1976)
- (1976) Phys. Rev. B , vol.13 , pp. 2270
- Zaremba, E.¹ Kohn, W.²

74
- 0006796417
- PRBMDO 0163-1829 10.1103/PhysRevB.27.6058
- B. N. J. Persson and P. Apell, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.27.6058 27, 6058 (1983)
- (1983) Phys. Rev. B , vol.27 , pp. 6058
- Persson, B.N.J.¹ Apell, P.²

75
- 0000646766
- PRBMDO 0163-1829 10.1103/PhysRevB.30.5669
- B. N. J. Persson and E. Zaremba, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.30.5669 30, 5669 (1984)
- (1984) Phys. Rev. B , vol.30 , pp. 5669
- Persson, B.N.J.¹ Zaremba, E.²

76
- 0001545642
- PRBMDO 0163-1829 10.1103/PhysRevB.33.7249
- A. Liebsch, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.33.7249 33, 7249 (1986)
- (1986) Phys. Rev. B , vol.33 , pp. 7249
- Liebsch, A.¹

77
- 0001437377
- PRBMDO 0163-1829 10.1103/PhysRevB.59.4708
- E. Hult, H. Rydberg, B. I. Lundqvist, and D. C. Langreth, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.4708 59, 4708 (1999)
- (1999) Phys. Rev. B , vol.59 , pp. 4708
- Hult, E.¹ Rydberg, H.² Lundqvist, B.I.³ Langreth, D.C.⁴

78
- 0035891051
- PRBMDO 0163-1829 10.1103/PhysRevB.64.195414
- E. Hult, P. Hyldgaard, J. Rossmeisl, and B. I. Lundqvist, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.64.195414 64, 195414 (2001).
- (2001) Phys. Rev. B , vol.64 , pp. 195414
- Hult, E.¹ Hyldgaard, P.² Rossmeisl, J.³ Lundqvist, B.I.⁴

79
- 43949131270
- L. Glasser (private communication).
- Glasser, L.¹

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.