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FP-(L)APW + lo study of mechanical stability and electronic behavior of CoGe in B20 structure Cover

FP-(L)APW + lo study of mechanical stability and electronic behavior of CoGe in B20 structure

Open Access
|Oct 2017

References

  1. [1] KRAJČĺ M., HAFNER J., Phys. Rev. B, 87 (2013), 035436.10.1103/PhysRevB.87.035436
  2. [2] LARCHEV V.I., POPOVA S.V., J. Less-Common Met., 87 (1982), 53.10.1016/0022-5088(82)90131-X
  3. [3] TAKIZAWA H., SATO T., ENDO T., SHIMADA M., J. Solid State Chem., 73 (1988), 40.10.1016/0022-4596(88)90051-5
  4. [4] DITUSA J.F., ZHANG S.B., YAMAURA K., XIONG Y., PRESTIGIACOMO J.C., FULFER B.W., ADAMS P.W., BRICKSON M.I., BROWNE D.A., CAPAN C., FISK Z., CHAN J.Y.,Phys. Rev. B, 90 (2014), 144404.10.1103/PhysRevB.90.144404
  5. [5] DONG S.S., LIU S.G., TAO X.M., XIAO F.H., HUANG L.H., YANG F., HE Y., CHEN Q., LIU H. S., JIN Z.P., Thermochim. Acta, 572 (2013), 94.10.1016/j.tca.2013.08.026
  6. [6] MACHADO K.D., GASPERINI A.A.M., MICHIELON DE SOUZA S., MAURMANN C.E., LIMA DE J.C., GRANDI T.A., Solid State Commun., 136 (2005), 466.10.1016/j.ssc.2005.09.006
  7. [7] MIKHAYLUSHKIN A.S., SATO T., CARLSON S., SIMAK S.I., H¨AUSSERMAN U.N., Phys. Rev. B, 77 (2008), 014102.10.1103/PhysRevB.77.014102
  8. [8] AMEEREH G.I., HAMAD B.A., KHALIFEH J.M., Physica B, 403 (2008), 3503.10.1016/j.physb.2008.05.020
  9. [9] GAZHULINA A.P., MARYCHEV M.O., J. Alloy. Compd., 623 (2015), 413.10.1016/j.jallcom.2014.11.028
  10. [10] KANAZAWA N., Charge and Heat Transport Phenomena in Electronic and Spin Structures in B20-type Compounds, Doctoral Thesis accepted by the University of Tokyo, Applied Physics Department, Tokyo, Springer Theses, 2015.10.1007/978-4-431-55660-2
  11. [11] HSIEH Y.F., CHEN L.J., MARSHALL E.D., LAU S.S., Appl. Phys. Lett., 51(1987), 1588.10.1063/1.98563
  12. [12] HSIEH Y.F., CHEN L.J., Thin Solid Films, 162 (1988), 295.10.1016/0040-6090(88)90218-0
  13. [13] MADSEN G.K.H., BLAHA P., SCHWARZ K., SJÖSTEDT E., NORDSTRÖM L., Phys. Rev. B, 64 (2001), 195134.10.1103/PhysRevB.64.195134
  14. [14] SCHWARZ K., BLAHA P., MADSEN G.K.H., Comput. Phys. Commun., 147 (2002), 71.10.1016/S0010-4655(02)00206-0
  15. [15] BADER R.F.W., Atoms in Molecules: A Quantum Theory, Oxford University Press, Oxford, 1990.10.1093/oso/9780198551683.001.0001
  16. [16] BADER R.F.W., NGUYEN-DANG T.T., TAL Y., Rep. Prog. Phys., 44 (1981), 893.10.1088/0034-4885/44/8/002
  17. [17] OTERO-DE-LA-ROZA A., JOHNSON E.R., LUAÑ A V., Comput. Phys. Commun., 185 (2014), 1007.10.1016/j.cpc.2013.10.026
  18. [18] OTERO-DE-LA-ROZA A., BLANCO M.A., PENDAS M.A., LUAÑA V., Comput. Phys. Commun., 180 (2009), 157.10.1016/j.cpc.2008.07.018
  19. [19] KOKALJ A., Comp. Mater. Sci., 28 (2003), 155.10.1016/S0927-0256(03)00104-6
  20. [20] BOUAFIA H., HIADSI S., ABIDRI B., AKRICHE A., GHALOUCI L., SAHLI B., Comp. Mater. Sci., 75 (2013), 1.10.1016/j.commatsci.2013.03.030
  21. [21] PERDEW J.P., BURKE K., ERNZERHOF M., Phys. Rev. Lett., 77 (1996), 3865.10.1103/PhysRevLett.77.386510062328
  22. [22] PERDEW J.P., RUZSINSZKY A., CSONKA G.I., VYDROV O.A., SCUSERIA G.E., CONSTANTIN L.A., ZHOU X., BURKE K., Phys. Rev. Lett., 100 (2008), 136406.10.1103/PhysRevLett.100.136406
  23. [23] HOHENBERG P., KOHN W., Phys. Rev. B, 136 (1964), 864.10.1103/PhysRev.136.B864
  24. [24] HIADSI S., BOUAFIA H., SAHLI B., ABIDRI B., BOUAZA A., AKRICHE A., Solid State Sci., 58 (2016), 1. 10.1016/j.solidstatesciences.2016.05.005
  25. [25] BLAHA P., SCHWARZ K., MADSEN G., KVASNICKA D., LUITZ J., WIEN2k, An Augmented Plane Wave + Local Orbitals Program for Calculating Crystal Properties, Karlheinz Schwarz, Techn. Universität Wien, Wien, 2001.
  26. [26] BLAHA P., SCHWARZ K., SORANTIN P., TRICKEY S.K., Comput. Phys. Commun., 59 (1990), 339.10.1016/0010-4655(90)90187-6
  27. [27] BLOCHL P., JEPSEN O., ANDERSEN O.K., Phys. Rev. B, 49 (1994), 16223.10.1103/PhysRevB.49.16223
  28. [28] MURNAGHAN F.D., P. Natl. Acad. Sci. USA, 30 (1944), 244.10.1073/pnas.30.9.244
  29. [29] WALLACE D.C., Thermodynamics of Cristals, Willey, New York, 1972.
  30. [30] JAMAL M., ASADABADI J.S., AHMAD I., ALIABAD R.H.A., Comp. Mater. Sci., 95 (2014), 592.10.1016/j.commatsci.2014.08.027
  31. [31] IRelast Package Provided by JAMAL M. as a part of the commercial Code Wien2k, http://www.wien2k.at/ (2014).
  32. [32] MEHL M.J., Phy. Rev. B, 47 (1993), 2493.10.1103/PhysRevB.47.2493
  33. [33] MEHL M.J., KLEIN B.K., PAPACONSTANTOPOULOS D.A., Intermetallic Compounds: Principle and Practice, in: WESTBROOK J.H., FLEISCHEIR R.L. (Eds.), Principles, Vol. I, John Wiley and Sons, 1995.
  34. [34] VOIGT W., Lehrbush der Kristallphysik, Taubner B.B, Leipzig, 1928.
  35. [35] SCHREIBER E., ANDERSON O.L., SOGA N., Elastic Constants and Their Measurements, McGraw-Hill, New York, 1973.
  36. [36] ROYLANCE D., Mech. Prop. Mater., 2008.
  37. [37] PUGH S.F., Philo. Mag., 45 (1954), 823.10.1080/14786440808520496
  38. [38] MAYER B., ANTON H., BOTT E., METHFESSEL M., STICHT J., SCHMIDT P.C., Intermetallics, 11 (2003), 23.10.1016/S0966-9795(02)00127-9
  39. [39] ANDERSON O.L., J. Phys. Chem. Solids, 24 (1963), 909.10.1016/0022-3697(63)90067-2
  40. [40] JAMAL M., SARVESTANI K.N., YAZDANI A., RESHAK A.H., RSC Adv., 4 (2014), 57903.10.1039/C4RA09358E
  41. [41] WU X., VANDERBILT D., HAMANN D.R., Phys. Rev. B, 72 (2005), 0355105.10.1103/PhysRevB.72.035105
  42. [42] ANDERSON O.L., J. Phys. Chem. Solids, 12 (1959), 41.10.1016/0022-3697(59)90250-1
  43. [43] PAULING L., The Nature of Chemical Bond: An Introduction to Modern Structural Chemistry, Cornell University Press, Ithaca, 1960.
  44. [44] MORI-SÁNCHEZ P., PENDÁS M.A., LUAÑ A V., J. Am. Chem. Soc., 124 (2002), 14721.10.1021/ja027708t
  45. [45] BLANCO M.A., FRANCISCO E., LUAÑ A V., Comput. Phys. Commun., 158 (2004), 57.10.1016/j.comphy.2003.12.001
  46. [46] BLANCO M.A., PENDAS M.A., FRANCISCO E., RECIO J.M., FRANCO R., J. Mol. Struc-Theochem., 368 (1996), 245.10.1016/S0166-1280(96)90571-0
  47. [47] FLOREZ M., RECIO J.M., FRANCISCO E., BLANCO M.A., MARTIN PENDAS A., Phys. Rev. B, 66 (2002), 144112.10.1103/PhysRevB.66.144112
  48. [48] FRANCISCO E., RECIO J.M., BLANCO M.A., MARTIN PENDAS A., J. Phys. Chem. A, 102 (1998), 1595.10.1021/jp972516j
  49. [49] FRANCISCO E., BLANCO M.A., SANJURJO G., Phys. Rev. B, 63 (2001), 094107.10.1103/PhysRevB.63.094107
  50. [50] POIRIER J.P., Introduction to the Physics of the Earth’s Interior, Vol. 39, Cambridge University Press, Oxford, 2000.
  51. [51] HILL R., Proc. Phys. Soc. London A, 65 (1952), 349.10.1088/0370-1298/65/5/307
  52. [52] PETIT A.T., DULONG P.L., Ann. Chim. Phys., 10 (1819), 395.
DOI: https://doi.org/10.1515/msp-2017-0051 | Journal eISSN: 2083-134X | Journal ISSN: 2083-1331
Language: English
Page range: 548 - 559
Submitted on: Oct 23, 2016
Accepted on: Apr 2, 2017
Published on: Oct 31, 2017
Published by: Wroclaw University of Science and Technology
In partnership with: Paradigm Publishing Services
Publication frequency: 4 issues per year

© 2017 M. A. Timaoui, H. Bouafia, B. Sahli, S. Hiadsi, B. Abidri, A. Bouaza, A. Akriche, D. Kerroum, published by Wroclaw University of Science and Technology
This work is licensed under the Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 License.