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Physical Review Letters

Volumn 111, Issue 17, 2013, Pages

First-principles theory of anharmonicity and the inverse isotope effect in superconducting palladium-hydride compounds

(3) Errea, Ion a,b Calandra, Matteo a Mauri, Francesco a

a SORBONNE UNIVERSITÉ (France)

b BASQUE FOUNDATION FOR SCIENCE (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

FIRST-PRINCIPLES THEORY; HARMONIC APPROXIMATION; ISOTOPE ANOMALIES; PALLADIUM HYDRIDE; STOCHASTIC APPROACH; SUPERCONDUCTING CRITICAL TEMPERATURES; SUPERCONDUCTING PROPERTIES; SUPERCONDUCTING TEMPERATURES;

CARRIER MOBILITY; HYDROGEN; PHONONS; SUPERCONDUCTIVITY; THERMAL EXPANSION;

ISOTOPES;

EID: 84886774344 PISSN: 00319007 EISSN: 10797114 Source Type: Journal
DOI: 10.1103/PhysRevLett.111.177002 Document Type: Article

Times cited : (270)

References (41)

1
- 0347190979
- PHRVAO 0031-899X 10.1103/PhysRev.108.1175
- J. Bardeen, L. N. Cooper, and J. R. Schrieffer, Phys. Rev. 108, 1175 (1957). PHRVAO 0031-899X 10.1103/PhysRev.108.1175
- (1957) Phys. Rev. , vol.108 , pp. 1175
- Bardeen, J.¹ Cooper, L.N.² Schrieffer, J.R.³

2
- 0035942739
- 2 as revealed by the reduced total isotope effect
- DOI 10.1038/35078037
- D. G. Hinks, H. Claus, and J. D. Jorgensen, Nature (London) 411, 457 (2001). NATUAS 0028-0836 10.1038/35078037 (Pubitemid 32494386)
- (2001) Nature , vol.411 , Issue.6836 , pp. 457-460
- Hinks, D.G.¹ Claus, H.² Jorgensen, J.D.³

3
- 0001107611
- PRLTAO 0031-9007 10.1103/PhysRevLett.83.404
- M. S. Fuhrer, K. Cherrey, A. Zettl, M. L. Cohen, and V. H. Crespi, Phys. Rev. Lett. 83, 404 (1999). PRLTAO 0031-9007 10.1103/PhysRevLett.83.404
- (1999) Phys. Rev. Lett. , vol.83 , pp. 404
- Fuhrer, M.S.¹ Cherrey, K.² Zettl, A.³ Cohen, M.L.⁴ Crespi, V.H.⁵

4
- 4243996594
- PRLTAO 0031-9007 10.1103/PhysRevLett.58.2333
- B. Batlogg, R. J. Cava, A. Jayaraman, R. B. van Dover, G. A. Kourouklis, S. Sunshine, D. W. Murphy, L. W. Rupp, H. S. Chen, A. White, K. T. Short, A. M. Mujsce, and E. A. Rietman, Phys. Rev. Lett. 58, 2333 (1987). PRLTAO 0031-9007 10.1103/PhysRevLett.58.2333
- (1987) Phys. Rev. Lett. , vol.58 , pp. 2333
- Batlogg, B.¹ Cava, R.J.² Jayaraman, A.³ Van Dover, R.B.⁴ Kourouklis, G.A.⁵ Sunshine, S.⁶ Murphy, D.W.⁷ Rupp, L.W.⁸ Chen, H.S.⁹ White, A.¹⁰ Short, K.T.¹¹ Mujsce, A.M.¹² Rietman, E.A.¹³

5
- 66249102963
- NATUAS 0028-0836 10.1038/nature07981
- R. H. Liu, T. Wu, G. Wu, H. Chen, X. F. Wang, Y. L. Xie, J. J. Ying, Y. J. Yan, Q. J. Li, B. C. Shi, W. S. Chu, Z. Y. Wu, and X. H. Chen, Nature (London) 459, 64 (2009). NATUAS 0028-0836 10.1038/nature07981
- (2009) Nature (London) , vol.459 , pp. 64
- Liu, R.H.¹ Wu, T.² Wu, G.³ Chen, H.⁴ Wang, X.F.⁵ Xie, Y.L.⁶ Ying, J.J.⁷ Yan, Y.J.⁸ Li, Q.J.⁹ Shi, B.C.¹⁰ Chu, W.S.¹¹ Wu, Z.Y.¹² Chen, X.H.¹³

6
- 0002457590
- ZEPYAA 0044-3328 10.1007/BF01398191
- B. Stritzker and W. Buckel, Z. Phys. 257, 1 (1972). ZEPYAA 0044-3328 10.1007/BF01398191
- (1972) Z. Phys. , vol.257 , pp. 1
- Stritzker, B.¹ Buckel, W.²

7
- 0343973610
- PLRBAQ 0556-2805 10.1103/PhysRevB.10.3818
- J. E. Schirber and C. J. M. Northrup, Phys. Rev. B 10, 3818 (1974). PLRBAQ 0556-2805 10.1103/PhysRevB.10.3818
- (1974) Phys. Rev. B , vol.10 , pp. 3818
- Schirber, J.E.¹ Northrup, C.J.M.²

8
- 0021598636
- Superconductivity of palladium tritide
- DOI 10.1016/0038-1098(84)90251-5
- J. E. Schirber, J. M. Mintz, and W. Wall, Solid State Commun. 52, 837 (1984). SSCOA4 0038-1098 10.1016/0038-1098(84)90251-5 (Pubitemid 15438771)
- (1984) Solid State Communications , vol.52 , Issue.10 , pp. 837-838
- Schirber, J.E.¹ Mintz, J.M.² Wall, W.³

9
- 0012085522
- ZETFA7 0044-4510
- A. E. Karakozov and E. G. Maksimov, Zh. Eksp. Teor. Fiz. 74, 681 (1978). ZETFA7 0044-4510
- (1978) Zh. Eksp. Teor. Fiz. , vol.74 , pp. 681
- Karakozov, A.E.¹ Maksimov, E.G.²

10
- 0026238102
- 0.99 and harmonic behaviour of their optical phonons
- DOI 10.1016/0921-4526(91)90616-M
- A. Kolesnikov, I. Natkaniec, V. Antonov, I. Belash, V. Fedotov, J. Krawczyk, J. Mayer, and E. Ponyatovsky, Physica (Amsterdam) 174B, 257 (1991). PHYBE3 0921-4526 10.1016/0921-4526(91)90616-M (Pubitemid 21721533)
- (1991) Physica B: Condensed Matter , vol.174 , Issue.1-4 , pp. 257-261
- Kolesnikov, A.I.¹ Natkaniec, I.² Antonov, V.E.³ Belash, I.T.⁴ Fedotov, V.K.⁵ Krawczyk, J.⁶ Mayer, J.⁷ Ponyatovsky, E.G.⁸

11
- 49449120324
- PYLAAG 0375-9601 10.1016/0375-9601(77)90439-X
- R. Sherman, H. K. Birnbaum, J. A. Holy, and M. V. Klein, Phys. Lett. 62A, 353 (1977). PYLAAG 0375-9601 10.1016/0375-9601(77)90439-X
- (1977) Phys. Lett. , vol.62 , pp. 353
- Sherman, R.¹ Birnbaum, H.K.² Holy, J.A.³ Klein, M.V.⁴

12
- 1542784737
- PRBMDO 0163-1829 10.1103/PhysRevB.58.2591
- D. K. Ross, V. E. Antonov, E. L. Bokhenkov, A. I. Kolesnikov, E. G. Ponyatovsky, and J. Tomkinson, Phys. Rev. B 58, 2591 (1998). PRBMDO 0163-1829 10.1103/PhysRevB.58.2591
- (1998) Phys. Rev. B , vol.58 , pp. 2591
- Ross, D.K.¹ Antonov, V.E.² Bokhenkov, E.L.³ Kolesnikov, A.I.⁴ Ponyatovsky, E.G.⁵ Tomkinson, J.⁶

13
- 0015646375
- SSCOA4 0038-1098 10.1016/0038-1098(73)90231-7
- M. Chowdhury and D. Ross, Solid State Commun. 13, 229 (1973). SSCOA4 0038-1098 10.1016/0038-1098(73)90231-7
- (1973) Solid State Commun. , vol.13 , pp. 229
- Chowdhury, M.¹ Ross, D.²

14
- 0001711484
- PRLTAO 0031-9007 10.1103/PhysRevLett.33.1297
- J. M. Rowe, J. J. Rush, H. G. Smith, M. Mostoller, and H. E. Flotow, Phys. Rev. Lett. 33, 1297 (1974). PRLTAO 0031-9007 10.1103/PhysRevLett.33.1297
- (1974) Phys. Rev. Lett. , vol.33 , pp. 1297
- Rowe, J.M.¹ Rush, J.J.² Smith, H.G.³ Mostoller, M.⁴ Flotow, H.E.⁵

15
- 5744243137
- PRLTAO 0031-9007 10.1103/PhysRevLett.57.2955
- J. M. Rowe, J. J. Rush, J. E. Schirber, and J. M. Mintz, Phys. Rev. Lett. 57, 2955 (1986). PRLTAO 0031-9007 10.1103/PhysRevLett.57.2955
- (1986) Phys. Rev. Lett. , vol.57 , pp. 2955
- Rowe, J.M.¹ Rush, J.J.² Schirber, J.E.³ Mintz, J.M.⁴

16
- 4243368830
- PRLTAO 0031-9007 10.1103/PhysRevLett.34.144
- R. J. Miller and C. B. Satterthwaite, Phys. Rev. Lett. 34, 144 (1975). PRLTAO 0031-9007 10.1103/PhysRevLett.34.144
- (1975) Phys. Rev. Lett. , vol.34 , pp. 144
- Miller, R.J.¹ Satterthwaite, C.B.²

17
- 4244077279
- PRLTAO 0031-9007 10.1103/PhysRevLett.39.574
- B. M. Klein, E. N. Economou, and D. A. Papaconstantopoulos, Phys. Rev. Lett. 39, 574 (1977). PRLTAO 0031-9007 10.1103/PhysRevLett.39.574
- (1977) Phys. Rev. Lett. , vol.39 , pp. 574
- Klein, B.M.¹ Economou, E.N.² Papaconstantopoulos, D.A.³

18
- 0001212893
- PRBMDO 0163-1829 10.1103/PhysRevB.44.10377 377
- C. Elsässer, K. M. Ho, C. T. Chan, and M. Fähnle, Phys. Rev. B 44, 10 377 (1991). PRBMDO 0163-1829 10.1103/PhysRevB.44.10377
- (1991) Phys. Rev. B , vol.44 , pp. 10
- Elsässer, C.¹ Ho, K.M.² Chan, C.T.³ Fähnle, M.⁴

19
- 3643076620
- PRBMDO 0163-1829 10.1103/PhysRevB.45.12405 405
- B. M. Klein and R. E. Cohen, Phys. Rev. B 45, 12 405 (1992). PRBMDO 0163-1829 10.1103/PhysRevB.45.12405
- (1992) Phys. Rev. B , vol.45 , pp. 12
- Klein, B.M.¹ Cohen, R.E.²

20
- 0001151847
- PLRBAQ 0556-2805 10.1103/PhysRevB.12.117
- J. E. Schirber and B. Morosin, Phys. Rev. B 12, 117 (1975). PLRBAQ 0556-2805 10.1103/PhysRevB.12.117
- (1975) Phys. Rev. B , vol.12 , pp. 117
- Schirber, J.E.¹ Morosin, B.²

21
- 5944257009
- PRBMDO 0163-1829 10.1103/PhysRevB.29.4140
- P. Jena, J. Jones, and R. M. Nieminen, Phys. Rev. B 29, 4140 (1984). PRBMDO 0163-1829 10.1103/PhysRevB.29.4140
- (1984) Phys. Rev. B , vol.29 , pp. 4140
- Jena, P.¹ Jones, J.² Nieminen, R.M.³

22
- 77957597554
- PRBMDO 1098-0121 10.1103/PhysRevB.82.104504
- B. Rousseau and A. Bergara, Phys. Rev. B 82, 104504 (2010). PRBMDO 1098-0121 10.1103/PhysRevB.82.104504
- (2010) Phys. Rev. B , vol.82 , pp. 104504
- Rousseau, B.¹ Bergara, A.²

23
- 84878985911
- PRBMDO 1098-0121 10.1103/PhysRevB.87.214303
- L. Paulatto, F. Mauri, and M. Lazzeri, Phys. Rev. B 87, 214303 (2013). PRBMDO 1098-0121 10.1103/PhysRevB.87.214303
- (2013) Phys. Rev. B , vol.87 , pp. 214303
- Paulatto, L.¹ Mauri, F.² Lazzeri, M.³

24
- 0037098508
- PRBMDO 0163-1829 10.1103/PhysRevB.65.245402
- M. Lazzeri and S. de Gironcoli, Phys. Rev. B 65, 245402 (2002). PRBMDO 0163-1829 10.1103/PhysRevB.65.245402
- (2002) Phys. Rev. B , vol.65 , pp. 245402
- Lazzeri, M.¹ De Gironcoli, S.²

25
- 0005647161
- D. J. Hooton, Philosophical Magazine Series 7 46, 422 (1955).
- (1955) Philosophical Magazine Series 7 , vol.46 , pp. 422
- Hooton, D.J.¹

26
- 40849136341
- Entropy driven stabilization of energetically unstable crystal structures explained from first principles theory
- DOI 10.1103/PhysRevLett.100.095901
- P. Souvatzis, O. Eriksson, M. I. Katsnelson, and S. P. Rudin, Phys. Rev. Lett. 100, 095901 (2008). PRLTAO 0031-9007 10.1103/PhysRevLett.100.095901 (Pubitemid 351399039)
- (2008) Physical Review Letters , vol.100 , Issue.9 , pp. 095901
- Souvatzis, P.¹ Eriksson, O.² Katsnelson, M.I.³ Rudin, S.P.⁴

27
- 82455209565
- PRBMDO 1098-0121 10.1103/PhysRevB.84.180301
- O. Hellman, I. A. Abrikosov, and S. I. Simak, Phys. Rev. B 84, 180301 (2011). PRBMDO 1098-0121 10.1103/PhysRevB.84.180301
- (2011) Phys. Rev. B , vol.84 , pp. 180301
- Hellman, O.¹ Abrikosov, I.A.² Simak, S.I.³

28
- 84876170994
- PRBMDO 1098-0121 10.1103/PhysRevB.87.144302
- B. Monserrat, N. D. Drummond, and R. J. Needs, Phys. Rev. B 87, 144302 (2013). PRBMDO 1098-0121 10.1103/PhysRevB.87.144302
- (2013) Phys. Rev. B , vol.87 , pp. 144302
- Monserrat, B.¹ Drummond, N.D.² Needs, R.J.³

29
- 79960643010
- PRLTAO 0031-9007 10.1103/PhysRevLett.106.165501
- I. Errea, B. Rousseau, and A. Bergara, Phys. Rev. Lett. 106, 165501 (2011). PRLTAO 0031-9007 10.1103/PhysRevLett.106.165501
- (2011) Phys. Rev. Lett. , vol.106 , pp. 165501
- Errea, I.¹ Rousseau, B.² Bergara, A.³

30
- 84863308321
- JAPIAU 0021-8979 10.1063/1.4726161
- I. Errea, B. Rousseau, and A. Bergara, J. Appl. Phys. 111, 112604 (2012). JAPIAU 0021-8979 10.1063/1.4726161
- (2012) J. Appl. Phys. , vol.111 , pp. 112604
- Errea, I.¹ Rousseau, B.² Bergara, A.³

31
- 18144397474
- 25Mg NMR shielding in MgO at finite temperature: Rovibrational effect in solids
- DOI 10.1021/jp044251w
- S. Rossano, F. Mauri, C. J. Pickard, and I. Farnan, J. Phys. Chem. B 109, 7245 (2005). JPCBFK 1520-6106 10.1021/jp044251w (Pubitemid 40609855)
- (2005) Journal of Physical Chemistry B , vol.109 , Issue.15 , pp. 7245-7250
- Rossano, S.¹ Mauri, F.² Pickard, C.J.³ Farnan, I.⁴

32
- 70349568754
- JCOMEL 0953-8984 10.1088/0953-8984/21/39/395502
- P. Giannozzi, J. Phys. Condens. Matter 21, 395502 (2009). JCOMEL 0953-8984 10.1088/0953-8984/21/39/395502
- (2009) J. Phys. Condens. Matter , vol.21 , pp. 395502
- Giannozzi, P.¹

33
- 0035535380
- RMPHAT 0034-6861 10.1103/RevModPhys.73.515
- S. Baroni, S. de Gironcoli, A. D. Corso, and P. Giannozzi, Rev. Mod. Phys. 73, 515 (2001). RMPHAT 0034-6861 10.1103/RevModPhys.73.515
- (2001) Rev. Mod. Phys. , vol.73 , pp. 515
- Baroni, S.¹ De Gironcoli, S.² Corso, A.D.³ Giannozzi, P.⁴

34
- 26144450583
- PRBMDO 0163-1829 10.1103/PhysRevB.23.5048
- J. P. Perdew and A. Zunger, Phys. Rev. B 23, 5048 (1981). PRBMDO 0163-1829 10.1103/PhysRevB.23.5048
- (1981) Phys. Rev. B , vol.23 , pp. 5048
- Perdew, J.P.¹ Zunger, A.²

35
- 33746213882
- PRBMDO 0163-1829 10.1103/PhysRevB.52.6301
- W. Zhong, D. Vanderbilt, and K. M. Rabe, Phys. Rev. B 52, 6301 (1995). PRBMDO 0163-1829 10.1103/PhysRevB.52.6301
- (1995) Phys. Rev. B , vol.52 , pp. 6301
- Zhong, W.¹ Vanderbilt, D.² Rabe, K.M.³

36
- 84886770984
- See Supplemental Material at http://link.aps.org/supplemental/10.1103/ PhysRevLett.111.177002 for a description of the model potential.

37
- 31444443824
- JPFMAT 0305-4608 10.1088/0305-4608/10/3/006
- R. Abbenseth and H. Wipf, J. Phys. F 10, 353 (1980). JPFMAT 0305-4608 10.1088/0305-4608/10/3/006
- (1980) J. Phys. F , vol.10 , pp. 353
- Abbenseth, R.¹ Wipf, H.²

38
- 0000310328
- PLRBAQ 0556-2805 10.1103/PhysRevB.12.905
- P. B. Allen and R. C. Dynes, Phys. Rev. B 12, 905 (1975). PLRBAQ 0556-2805 10.1103/PhysRevB.12.905
- (1975) Phys. Rev. B , vol.12 , pp. 905
- Allen, P.B.¹ Dynes, R.C.²

39
- 77649297848
- PNASA6 0027-8424 10.1073/pnas.0914462107
- D. Y. Kim, R. H. Scheicher, H.-k. Mao, T. W. Kang, and R. Ahuja, Proc. Natl. Acad. Sci. U.S.A. 107, 2793 (2010). PNASA6 0027-8424 10.1073/pnas. 0914462107
- (2010) Proc. Natl. Acad. Sci. U.S.A. , vol.107 , pp. 2793
- Kim, D.Y.¹ Scheicher, R.H.² Mao, H.-K.³ Kang, T.W.⁴ Ahuja, R.⁵

40
- 80052504319
- PRLTAO 0031-9007 10.1103/PhysRevLett.107.117002
- D. Y. Kim, R. H. Scheicher, C. J. Pickard, R. J. Needs, and R. Ahuja, Phys. Rev. Lett. 107, 117002 (2011). PRLTAO 0031-9007 10.1103/PhysRevLett.107. 117002
- (2011) Phys. Rev. Lett. , vol.107 , pp. 117002
- Kim, D.Y.¹ Scheicher, R.H.² Pickard, C.J.³ Needs, R.J.⁴ Ahuja, R.⁵

41
- 0004022574
- Addison-Wesley, Reading, MA
- G. Grüner, Density Waves in Solids (Addison-Wesley, Reading, MA, 1994).
- (1994) Density Waves in Solids
- Grüner, G.¹

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