PL EN


Preferencje help
Widoczny [Schowaj] Abstrakt
Liczba wyników
Czasopismo
2010 | 8 | 1 | 126-133
Tytuł artykułu

Role of temperature in the numerical analysis of CaO under high pressure

Treść / Zawartość
Warianty tytułu
Języki publikacji
EN
Abstrakty
EN
In this paper we focus on the elastic and thermodynamic properties of the B1 phase of CaO by using the modified TBP model, including the role of temperature. We have successfully obtained the phase transition pressure and volume change at different temperatures. In addition elastic constants and bulk modulus of B1 phase of CaO at different temperatures are discussed. Our results are comparable with the previous ones at high temperatures and pressures. The thermodynamical properties of the B1 phase of CaO are also predicted. [...]
Wydawca

Czasopismo
Rocznik
Tom
8
Numer
1
Strony
126-133
Opis fizyczny
Daty
wydano
2010-02-01
online
2010-02-16
Twórcy
autor
  • Department of Physics, Barkatullah University, Bhopal, 462026, India
Bibliografia
  • [1] T. Yamanaka, K. Kittaka, T. Nagai, J. Mineral. Petrol. Sci. 97, 144 (2002)
  • [2] J.B. Hu, Y.Y. Yu, D.C. Dai, H. Tan, Acta Phys. Sin. 54, 5750 (2005)
  • [3] Y.M. Tao, H.X. Cao, Q. Jiang, Acta Phys. Sin. 54, 274 (2005)
  • [4] R. Jeanloz, T.J. Ahrens, H.K. Mao, P.M. Bell, Science 206, 829 (1979)
  • [5] J.F. Mammone, H.K. Mao, P.M. Bell, Geophys. Res. Lett. 8, 140 (1981) http://dx.doi.org/10.1029/GL008i002p00140[Crossref]
  • [6] P. Richet, H.K. Mao, P.M. Bell, Geophys. Res. Lett. 93, 15279 (1988)
  • [7] Z.P. Chang, K.E. Graham, J. Phys. Chem. Solids 38, 1355 (1977) http://dx.doi.org/10.1016/0022-3697(77)90007-5[Crossref]
  • [8] H. Oda, O.L. Anderson, D.G. Isaak, I. Suzuki, Phys. Chem. Miner. 19, 96 (1992) http://dx.doi.org/10.1007/BF00198607[Crossref]
  • [9] R. Jeanloz, T.J. Ahrens, Geophys. J. R. Astron. Soc. 62, 505 (1980) [Crossref]
  • [10] M. Catti, Phys. Rev. B 68, 100101 (2003) http://dx.doi.org/10.1103/PhysRevB.68.100101[Crossref]
  • [11] A. Aguado, L. Bernasconi, P.A. Madden, J. Chem. Phys. 118, 5704 (2003) http://dx.doi.org/10.1063/1.1556074[Crossref]
  • [12] B.B. Karki, J. Crain, J. Geophys. Res. 103, 12405 (1998) http://dx.doi.org/10.1029/97JB03674[Crossref]
  • [13] G. Kalpana, B. Palanivel, M. Rajagopalan, Phys. Rev. B 52 4 (1995) http://dx.doi.org/10.1103/PhysRevB.52.4[Crossref]
  • [14] H. Zhang, M.S.T. Bukowinski, Phys. Rev. B 44, 2495 (1991) http://dx.doi.org/10.1103/PhysRevB.44.2495[Crossref]
  • [15] M.J. Mehl, R.E. Cohen, H. Krakauer, J. Geophys. Res. 93, 8009 (1988) http://dx.doi.org/10.1029/JB093iB07p08009[Crossref]
  • [16] M.J. Mehl, R.J. Hemley, L.L. Boyer, Phys. Rev. B 33, 8685 (1986) http://dx.doi.org/10.1103/PhysRevB.33.8685[Crossref]
  • [17] M.S.T Bukowinski, Geophys. Res. Lett. 12, 536 (1985) http://dx.doi.org/10.1029/GL012i008p00536[Crossref]
  • [18] A.J. Cohen, R.J. Gordon, Phys. Rev. B 14, 4593 (1976) http://dx.doi.org/10.1103/PhysRevB.14.4593[Crossref]
  • [19] T. Tsuchiya, K. Kawamura, J. Chem. Phys. 114, 10086 (2001) http://dx.doi.org/10.1063/1.1371498[Crossref]
  • [20] J. Shanker, S.S. Kushwah, P. Kumar, Physica B 233, 78 (1997) http://dx.doi.org/10.1016/S0921-4526(96)01238-0[Crossref]
  • [21] B.B. Karki, G.J. Ackland, J. Crain, J. Physics Condensed Matter 9, 8579 (1997) http://dx.doi.org/10.1088/0953-8984/9/41/005[Crossref]
  • [22] B.B. Karki, R.M. Wentzcovitch, Phys. Rev. B 68, 224304 (2003) http://dx.doi.org/10.1103/PhysRevB.68.224304[Crossref]
  • [23] B.B. Karki, R.M. Wentzcovitch, S. Baroni, Science 286, 1705 (1999); B.B. Karki, R.M. Wentzcovitch, S. Baroni, Phys. Rev. B 61, 8793 (2000) http://dx.doi.org/10.1126/science.286.5445.1705[Crossref]
  • [24] B.B. Karki, L. Stixrude, S.J. Clark, M.C. Warren, G.J. Ackland, J. Crain, American Minneralogist 82, 51 (1997) [Crossref]
  • [25] M. Alfredsson et al., Mol. Simul. 31, 367 (2005) http://dx.doi.org/10.1080/08927020500066684[Crossref]
  • [26] T. Yamanaka, K. Kittaka, T. Nagai, J. Mineral. Petrol. Sci. 97, 144 (2002) [Crossref]
  • [27] Y. Deng, O.-H. Jia, X.-R. Chen, J. Zhu, Physica B 392, 229 (2007) http://dx.doi.org/10.1016/j.physb.2006.11.023[Crossref]
  • [28] A.J. Cohen, R.G. Gordon, Phys. Rev. B 12, 3228 (1975) http://dx.doi.org/10.1103/PhysRevB.12.3228[Crossref]
  • [29] C.E. Sims, G.D. Barrera, N.L. Allan, Phys. Rev. B 57, 11164 (1998) http://dx.doi.org/10.1103/PhysRevB.57.11164[Crossref]
  • [30] R. K Singh, Phys. Reports 85, 259 (1982) http://dx.doi.org/10.1016/0370-1573(82)90020-5[Crossref]
  • [31] M.P. Tosi, F.G. Fumi, J. Phys. Chem. Solids 23, 359 (1962) http://dx.doi.org/10.1016/0022-3697(62)90103-8[Crossref]
  • [32] M.P. Tosi, Solid State Physics 16, 1 (1964)
  • [33] D. Varshney, N. Kaurav, R. Kinge, R.K. Singh, High Pressure Research 25, 145 (2005) http://dx.doi.org/10.1080/08957950500162864[Crossref]
  • [34] A. Gaur, S. Singh, R.K. Singh, J. Alloys Compd. 468, 438 (2008) http://dx.doi.org/10.1016/j.jallcom.2008.01.017[Crossref]
  • [35] J. Shanker, W.N. Bhende, Phys. Stat. Sol. 136, 11 (1986) http://dx.doi.org/10.1002/pssb.2221360102[Crossref]
  • [36] R.K. Singh, N.K. Gaur, Physica B 150, 385 (1988) http://dx.doi.org/10.1016/0378-4363(88)90079-4[Crossref]
  • [37] R.K. Singh, N.K. Gaur, Phys. Rev. B 39, 671 (1989) http://dx.doi.org/10.1103/PhysRevB.39.671[Crossref]
  • [38] P. Bhardwaj, S. Singh, N.K. Gaur, Mat. Res. Bull. 44, 1366 (2009) http://dx.doi.org/10.1016/j.materresbull.2008.12.012[Crossref]
  • [39] P. Bhardwaj, S. Singh, N.K. Gaur, J. of Molecular Structure: THEOCHEM, 897, 95 (2009) http://dx.doi.org/10.1016/j.theochem.2008.11.033[Crossref]
  • [40] R.K. Singh, S. Singh, Phys. Rev. B 45, 1019 (1992) http://dx.doi.org/10.1103/PhysRevB.45.1019[Crossref]
  • [41] R.K. Singh S. Singh, Phase Transition 15, 127 (1989) http://dx.doi.org/10.1080/01411598908206842[Crossref]
  • [42] D.R. Lide (Ed), CRC Handbook of Chemistry and Physics, 76th edition (CRC Press Inc., Boca Raton, FL, 1995–1996) 21
  • [43] X. Li and R. Jeanloz, Phys. Rev. B 36, 474 (1987) http://dx.doi.org/10.1103/PhysRevB.36.474[Crossref]
  • [44] W.A Bassett, T. Takahashi, H.K. Mao, J.S. Weaver, J. Appl. Phys. 39, 319 (1968) http://dx.doi.org/10.1063/1.1655752[Crossref]
Typ dokumentu
Bibliografia
Identyfikatory
Identyfikator YADDA
bwmeta1.element.-psjd-doi-10_2478_s11532-009-0117-9
JavaScript jest wyłączony w Twojej przeglądarce internetowej. Włącz go, a następnie odśwież stronę, aby móc w pełni z niej korzystać.