Zone-center phonons in Na V2 O5: A comprehensive ab initio study including Raman spectra and electron-phonon interaction

Physical Review B - Condensed Matter and Materials Physics

Volumn 75, Issue 1, 2007, Pages

  Spitaler, J ^a,b   Sherman, E Ya ^c   Ambrosch Draxl, C ^a,b  

^a UNIVERSITY OF LEOBEN   (Austria)

^b UNIVERSITY OF GRAZ   (Austria)

^c UNIVERSITY OF TORONTO   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 33846388268     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.75.014302     Document Type: Article

References (56)

1. E. Dagotto, Science SCIEAS 0036-8075 10.1126/science.1107559 309, 257 (2005).
2. E. Dagotto and T. M. Rice, Science SCIEAS 0036-8075 10.1126/science.274. 5287.618 271, 618 (1996).
3. L. Hozoi, S. Nishimoto, and A. Yamasaki, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.72.195117 72, 195117 (2005).
4. P. Lemmens, M. Fischer, M. Grove, P. H. M. v. Loosdrecht, G. Els, E. Y. Sherman, C. Pinettes, and G. Güntherodt, in Advances in Solid State Physics (edited by, R. Helbig,), Vol. 39 (Vieweg Verlag, Wiesbaden, Germany, 1999), p. 181.
5. P. Lemmens, G. Güntherodt, and C. Gros, Phys. Rep. PRPLCM 0370-1573 10.1016/S0370-1573(02)00321-6 375, 1 (2003).
6. A. Meetsma, J. L. de Boer, A. Damascelli, J. Jegoudez, A. Revcolevschi, and T. T. M. Palstra, Acta Crystallogr., Sect. C: Cryst. Struct. Commun. ACSCEE 0108-2701 10.1107/S0108270198004855 54, 1558 (1998).
7. H. G. v. Schnering, Y. Grin, M. Kaupp, M. Somer, R. K. Kremer, O. Jepsen, T. Chatterji, and M. Weiden, Z. Kristallogr. - New Cryst. Struct. ZKNSFT 1433-7266 213 (2), 246 (1998).
8. H. Smolinski, C. Gros, W. Weber, U. Peuchert, G. Roth, M. Weiden, and C. Geibel, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.80.5164 80, 5164 (1998).
9. Figure produced with XCrySDen: A. Kokalj, Comput. Mater. Sci. CMMSEM 0927-0256 10.1016/S0927-0256(03)00104-6 28, 155 (2003);
10. code available from http://www.xcrysden.org/
11. M. Isobe and Y. Ueda, J. Phys. Soc. Jpn. JUPSAU 0031-9015 10.1143/JPSJ.65.1178 65, 1178 (1996).
12. M. Weiden, R. Hauptmann, C. Geibel, F. Steglich, M. Fischer, P. Lemmens, and G. Güntherodt, Z. Phys. B: Condens. Matter ZPCMDN 0722-3277 10.1007/s002570050342 103, 1 (1997).
13. A. Bernert, T. Chatterji, P. Thalmeier, and P. Fulde, Eur. Phys. J. B EPJBFY 1434-6028 10.1007/s100510170164 21, 535 (2001).
14. J. Lüdecke, A. Jobst, S. van Smaalen, E. Morré, C. Geibel, and H.-G. Krane, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.82.3633 82, 3633 (1999).
15. H. Nakao, K. Ohwada, N. Takesue, Y. Fujii, M. Isobe, Y. Ueda, M. v. Zimmermann, J. P. Hill, D. Gibbs, J. C. Woicik, I. Koyama, and Y. Murakami, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.85.4349 85, 4349 (2000).
16. K. Ohwada, Y. Fujii, Y. Katsuki, J. Muraoka, H. Nakao, Y. Murakami, H. Sawa, E. Ninomiya, M. Isobe, and Y. Ueda, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.94.106401 94, 106401 (2005).
17. H. Sawa, E. Ninomiya, T. Ohama, H. Nakao, K. Ohwada, Y. Murakami, Y. Fujii, Y. Noda, M. Isobe, and Y. Ueda, J. Phys. Soc. Jpn. JUPSAU 0031-9015 10.1143/JPSJ.71.385 71, 385 (2002).
18. S. van Smaalen, P. Daniels, L. Palatinus, and R. K. Kremer, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.060101 65, 060101 (R) (2002).
19. M. N. Popova, A. B. Sushkov, S. A. Klimin, E. P. Chukalina, B. Z. Malkin, M. Isobe, and Y. Ueda, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.144303 65, 144303 (2002).
20. M. Fischer, P. Lemmens, G. Els, G. Güntherodt, E. Y. Sherman, E. Morré, C. Geibel, and F. Steglich, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.60.7284 60, 7284 (1999).
21. S. Grenier, A. Toader, J. E. Lorenzo, Y. Joly, B. Grenier, S. Ravy, L. P. Regnault, H. Renevier, J. Y. Henry, J. Jegoudez, and A. Revcolevschi, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.180101 65, 180101 (R) (2002).
22. M. J. Konstantinović, Z. V. Popović, V. N. Vasil'ev, Y. Ueda, and V. V. Moshchalkov, Solid State Commun. SSCOA4 0038-1098 10.1016/S0038-1098(99)00338-5 112, 397 (1999).
23. M. V. Mostovoy and D. I. Khomski, Solid State Commun. SSCOA4 0038-1098 10.1016/S0038-1098(99)00453-6 113, 159 (2000).
24. H. Seo and H. Fukuyama, J. Phys. Soc. Jpn. JUPSAU 0031-9015 10.1143/JPSJ.67.2602 67, 2602 (1998).
25. E. Y. Sherman, M. Fischer, P. Lemmens, P. H. M. van Loosdrecht, and G. Güntherodt, Europhys. Lett. EULEEJ 0295-5075 10.1209/epl/i1999-00533-6 48, 648 (1999).
26. H. Nojiri, S. Luther, M. Motokawa, M. Isobe, and Y. Ueda, J. Phys. Soc. Jpn. JUPSAU 0031-9015 10.1143/JPSJ.69.2291 69, 2291 (2000).
27. Z. V. Popovic and F. R. Vukajlovic, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.5333 59, 5333 (1999).
28. J. Spitaler, E. Y. Sherman, H. G. Evertz, and C. Ambrosch-Draxl, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.70.125107 70, 125107 (2004).
29. H. Wu and Q. Q. Zheng, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59. 15027 59, 15027 (1999).
30. A. N. Yaresko, V. N. Antonov, H. Eschrig, P. Thalmeier, and P. Fulde, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.62.15538 62, 15538 (2000).
31. M. Aichhorn, P. Horsch, W. von der Linden, and M. Cuoco, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.201101 65, 201101 (R) (2002).
32. P. Horsch and F. Mack, Eur. Phys. J. B EPJBFY 1434-6028 10.1007/s100510050455 5, 367 (1998).
33. A. Hübsch, C. Waidacher, K. W. Becker, and W. von der Linden, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.64.075107 64, 075107 (2001).
34. V. Yushankhai and P. Thalmeier, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.63.064402 63, 064402 (2001).
35. N. Suaud and M.-B. Lepetit, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.62.402 62, 402 (2000).
36. R. C. Rai, J. Cao, J. L. Musfeldt, D. J. Singh, X. Wei, R. Jin, Z. X. Zhou, B. C. Sales, and D. Mandrus, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.73.075112 73, 075112 (2006).
37. M. Aichhorn, M. Hohenadler, E. Y. Sherman, J. Spitaler, C. Ambrosch-Draxl, and H. G. Evertz, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.69.245108 69, 245108 (2004).
38. M. Aichhorn, E. Y. Sherman, and H. G. Evertz, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.72.155110 72, 155110 (2005).
39. B. Edegger, H. G. Evertz, and R. M. Noack, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.72.085131 72, 085131 (2005).
40. B. Edegger, H. G. Evertz, and R. M. Noack, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.96.146401 96, 146401 (2006).
41. C. Gabriel, E. Sherman, T. C. Lang, M. Aichhorn, and H. G. Evertz, Physica B PHYBE3 0921-4526 359-361, 1400 (2005).
42. E. Sjöstedt, L. Nordström, and D. J. Singh, Solid State Commun. SSCOA4 0038-1098 10.1016/S0038-1098(99)00577-3 114, 15 (2000).
43. P. Blaha, K. Schwarz, and J. Luitz (1997)
44. [Improved and updated Unix version of the original copyright WIEN code, which was published by P. Blaha, K. Schwarz, P. Sorantin, and S. B. Trickey, Comput. Phys. Commun. CPHCBZ 0010-4655 10.1016/0010-4655(90)90187-6 59, 399 (1990)].
45. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865 77, 3865 (1996).
46. C. Ambrosch-Draxl, H. Auer, R. Kouba, E. Y. Sherman, P. Knoll, and M. Mayer, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.064501 65, 064501 (2002).
47. W. S. Bacsa, R. Lewandowska, A. Zwick, and P. Millet, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.61.R14885 61, R14885 (2000).
48. S. A. Golubchik, M. Isobe, A. Ivlev, B. Mavrin, M. N. Popova, A. B. Sushkov, Y. Ueda, and A. Vasil'ev, J. Phys. Soc. Jpn. JUPSAU 0031-9015 10.1143/JPSJ.66.4042 66, 4042 (1997).
49. M. N. Popova, A. B. Sushkov, S. A. Golubchik, B. Mavrin, and V. N. Denisov, JETP JTPHES 1063-7761 10.1134/1.558909 88, 1186 (1999).
50. Z. V. Popović, M. J. Konstantinović, R. Gajić, V. Popov, Y. S. Raptis, A. N. Vasil'ev, M. Isobe, and Y. Ueda, J. Phys.: Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/10/29/005 10, L513 (1998).
51. Z. V. Popović, M. J. Konstantinović, R. Gajić, V. Popov, Y. S. Raptis, A. N. Vasil'ev, M. Isobe, and Y. Ueda, Solid State Commun. SSCOA4 0038-1098 10.1016/S0038-1098(99)00081-2 110, 381 (1999).
52. A. Damascelli, D. van der Marel, M. Grüninger, C. Presura, T. T. M. Palstra, J. Jegoudez, and A. Revcolevschi, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.81.918 81, 918 (1998).
53. D. Smirnov, J. Leotin, P. Millet, J. Jegoudez, and A. Revcolevschi, Physica B PHYBE3 0921-4526 10.1016/S0921-4526(98)00633-4 259, 992 (1999).
54. M. J. Konstantinović, Z. V. Popovic, A. N. Vasil'ev, M. Isobe, and Y. Ueda, J. Phys.: Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/11/9/007 11, 2103 (1999).
55. A. Gozar and G. Blumberg, Electronic Properties of α′ -Na V2 O5, from: "Frontiers in Magnetic Materials" (Springer-Verlag, Berlin, Germany, 2005), pp. 697-734.
56. M. J. Konstantinović, Z. V. Popović, T. Ruf, M. Cardona, A. N. Vasilev, M. Isobe, and Y. Ueda, Phys. Status Solidi B PSSBBD 0370-1972 10.1002/(SICI)1521-3951(199909)215:1<661::AID-PSSB661>3.0.CO;2-G 215, 661 (1999).