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Volumn 46, Issue 24, 2011, Pages 7839-7849

Structure and thermodynamics of the key precipitated phases in the Al-Mg-Si alloys from first-principles calculations

Author keywords

[No Author keywords available]

Indexed keywords

AL-MG-SI ALLOYS; CONSTANT PRESSURES; ENTHALPIES OF FORMATION; FIRST-PRINCIPLES CALCULATION; GIBBS FREE ENERGY OF FORMATION; HEAT CAPACITIES; METASTABLE EQUILIBRIA; PHONON DENSITY;

EID: 80053345085     PISSN: 00222461     EISSN: 15734803     Source Type: Journal    
DOI: 10.1007/s10853-011-5765-4     Document Type: Article
Times cited : (30)

References (58)
  • 1
    • 0030174747 scopus 로고    scopus 로고
    • 2Si-0.4mass% Si alloy
    • DOI 10.1016/1359-6462(96)00057-7, PII S1359646296000577
    • K Matsuda S Ikeno T Sato A Kamio 1996 Scr Mater 34 1797 10.1016/1359-6462(96)00057-7 1:CAS:528:DyaK28Xjt1GrsLc%3D (Pubitemid 126370113)
    • (1996) Scripta Materialia , vol.34 , Issue.11 , pp. 1797-1802
    • Matsuda, K.1    Ikeno, S.2    Sato, T.3    Kamio, A.4
  • 2
    • 0030874912 scopus 로고    scopus 로고
    • 6:particles in Al by dynamic electron diffraction studies
    • DOI 10.1126/science.277.5330.1221
    • HW Zandbergen SJ Andersen J Jansen 1997 Science 277 1221 10.1126/science.277.5330.1221 1:CAS:528:DyaK2sXlslaisLs%3D (Pubitemid 27449061)
    • (1997) Science , vol.277 , Issue.5330 , pp. 1221-1225
    • Zandbergen, H.W.1    Andersen, S.J.2    Jansen, J.3
  • 5
    • 3242660809 scopus 로고    scopus 로고
    • 10.1016/j.actamat.2004.05.037 1:CAS:528:DC%2BD2cXlvFamu7o%3D
    • C Ravi C Wolverton 2004 Acta Mater 52 4213 10.1016/j.actamat.2004.05.037 1:CAS:528:DC%2BD2cXlvFamu7o%3D
    • (2004) Acta Mater , vol.52 , pp. 4213
    • Ravi, C.1    Wolverton, C.2
  • 9
    • 33646844639 scopus 로고    scopus 로고
    • Phase stability and structural relations of nanometer-sized, matrix-embedded precipitate phases in Al-Mg-Si alloys in the late stages of evolution
    • DOI 10.1016/j.actamat.2006.02.034, PII S1359645406001686
    • MA Van Huis JH Chen HW Zandbergen MHF Sluiter 2006 Acta Mater 54 2945 10.1016/j.actamat.2006.02.034 (Pubitemid 43776745)
    • (2006) Acta Materialia , vol.54 , Issue.11 , pp. 2945-2955
    • Van Huis, M.A.1    Chen, J.H.2    Zandbergen, H.W.3    Sluiter, M.H.F.4
  • 13
    • 70350211848 scopus 로고    scopus 로고
    • 10.1007/s11669-009-9570-6 1:CAS:528:DC%2BD1MXht1OjtL3L
    • ZK Liu 2009 J Phase Equil Diffus 30 517 10.1007/s11669-009-9570-6 1:CAS:528:DC%2BD1MXht1OjtL3L
    • (2009) J Phase Equil Diffus , vol.30 , pp. 517
    • Liu, Z.K.1
  • 15
    • 73449122987 scopus 로고    scopus 로고
    • 10.1016/j.pmatsci.2009.05.002
    • B Fultz 2009 Prog Mater Sci 55 247 10.1016/j.pmatsci.2009.05.002
    • (2009) Prog Mater Sci , vol.55 , pp. 247
    • Fultz, B.1
  • 16
    • 2342515450 scopus 로고    scopus 로고
    • 10.1016/j.actamat.2004.02.014 1:CAS:528:DC%2BD2cXjsFOhtLk%3D
    • Y Wang ZK Liu LQ Chen 2004 Acta Mater 52 2665 10.1016/j.actamat.2004.02. 014 1:CAS:528:DC%2BD2cXjsFOhtLk%3D
    • (2004) Acta Mater , vol.52 , pp. 2665
    • Wang, Y.1    Liu, Z.K.2    Chen, L.Q.3
  • 17
    • 13844281576 scopus 로고    scopus 로고
    • Ab initio thermodynamic properties of stoichiometric phases in the Ni-Al system
    • DOI 10.1016/j.actamat.2004.12.030, PII S1359645404007669
    • R Arroyave D Shin ZK Liu 2005 Acta Mater 53 1809 10.1016/j.actamat.2004. 12.030 1:CAS:528:DC%2BD2MXhs1Gmu7c%3D (Pubitemid 40245698)
    • (2005) Acta Materialia , vol.53 , Issue.6 , pp. 1809-1819
    • Arroyave, R.1    Shin, D.2    Liu, Z.-K.3
  • 21
    • 0030190741 scopus 로고    scopus 로고
    • Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
    • DOI 10.1016/0927-0256(96)00008-0, PII S0927025696000080
    • G Kresse J Furthmüller 1996 Comput Mater Sci 6 15 10.1016/0927-0256(96)00008-0 1:CAS:528:DyaK28XmtFWgsrk%3D (Pubitemid 126412269)
    • (1996) Computational Materials Science , vol.6 , Issue.1 , pp. 15-50
    • Kresse, G.1    Furthmuller, J.2
  • 22
    • 2442537377 scopus 로고    scopus 로고
    • 10.1103/PhysRevB.54.11169 1:CAS:528:DyaK28Xms1Whu7Y%3D
    • G Kresse J Furthmüller 1996 Phys Rev B 54 11169 10.1103/PhysRevB.54. 11169 1:CAS:528:DyaK28Xms1Whu7Y%3D
    • (1996) Phys Rev B , vol.54 , pp. 11169
    • Kresse, G.1    Furthmüller, J.2
  • 23
    • 25744460922 scopus 로고
    • 10.1103/PhysRevB.50.17953
    • PE Blöchl 1994 Phys Rev B 50 17953 10.1103/PhysRevB.50.17953
    • (1994) Phys Rev B , vol.50 , pp. 17953
    • Blöchl, P.E.1
  • 24
    • 0011236321 scopus 로고    scopus 로고
    • 10.1103/PhysRevB.59.1758 1:CAS:528:DyaK1MXkt12nug%3D%3D
    • G Kresse D Joubert 1999 Phys Rev B 59 1758 10.1103/PhysRevB.59.1758 1:CAS:528:DyaK1MXkt12nug%3D%3D
    • (1999) Phys Rev B , vol.59 , pp. 1758
    • Kresse, G.1    Joubert, D.2
  • 25
    • 4243943295 scopus 로고    scopus 로고
    • 10.1103/PhysRevLett.77.3865 1:CAS:528:DyaK28XmsVCgsbs%3D
    • JP Perdew K Burke M Ernzerhof 1996 Phys Rev Lett 77 3865 10.1103/PhysRevLett.77.3865 1:CAS:528:DyaK28XmsVCgsbs%3D
    • (1996) Phys Rev Lett , vol.77 , pp. 3865
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 28
    • 67349125396 scopus 로고    scopus 로고
    • 10.1016/j.calphad.2008.12.005
    • A Van de Walle 2009 CALPHAD 33 266 10.1016/j.calphad.2008.12.005
    • (2009) CALPHAD , vol.33 , pp. 266
    • Van De Walle, A.1
  • 29
    • 0009955492 scopus 로고    scopus 로고
    • 10.1103/PhysRevB.59.4100 1:CAS:528:DyaK1MXosVersg%3D%3D
    • MHF Sluiter M Weinert Y Kawazoe 1999 Phys Rev B 59 4100 10.1103/PhysRevB.59.4100 1:CAS:528:DyaK1MXosVersg%3D%3D
    • (1999) Phys Rev B , vol.59 , pp. 4100
    • Sluiter, M.H.F.1    Weinert, M.2    Kawazoe, Y.3
  • 32
    • 0026242171 scopus 로고
    • 10.1016/0364-5916(91)90030-N
    • AT Dinsdale 1991 CALPHAD 4 317 10.1016/0364-5916(91)90030-N
    • (1991) CALPHAD , vol.4 , pp. 317
    • Dinsdale, A.T.1
  • 33
    • 0001336320 scopus 로고
    • 10.1063/1.1698520 1:CAS:528:DyaH1MXkvFCitQ%3D%3D
    • ME Straumanis 1949 J Appl Phys 20 726 10.1063/1.1698520 1:CAS:528:DyaH1MXkvFCitQ%3D%3D
    • (1949) J Appl Phys , vol.20 , pp. 726
    • Straumanis, M.E.1
  • 34
    • 0042888322 scopus 로고
    • 10.1107/S0365110X62001474 1:CAS:528:DyaF38Xkt1Kqu7w%3D
    • AS Cooper 1962 Acta Crystallogr 15 578 10.1107/S0365110X62001474 1:CAS:528:DyaF38Xkt1Kqu7w%3D
    • (1962) Acta Crystallogr , vol.15 , pp. 578
    • Cooper, A.S.1
  • 35
    • 84982347889 scopus 로고
    • 10.1002/pssb.19620020803 1:CAS:528:DyaF3sXjs1Ohtw%3D%3D
    • BN Dutta 1962 Phys Status Solidi 2 984 10.1002/pssb.19620020803 1:CAS:528:DyaF3sXjs1Ohtw%3D%3D
    • (1962) Phys Status Solidi , vol.2 , pp. 984
    • Dutta, B.N.1
  • 36
    • 73449092467 scopus 로고    scopus 로고
    • 10.1016/j.cpc.2009.11.017 1:CAS:528:DC%2BC3cXjtVWhtg%3D%3D
    • R Yu J Zhu HQ Ye 2010 Comput Phys Commun 181 671 10.1016/j.cpc.2009.11. 017 1:CAS:528:DC%2BC3cXjtVWhtg%3D%3D
    • (2010) Comput Phys Commun , vol.181 , pp. 671
    • Yu, R.1    Zhu, J.2    Ye, H.Q.3
  • 38
    • 0023994275 scopus 로고
    • ASED band theory: Lattice constants, atomization energies, and bulk moduli for C(gr), C(di), Si, alpha -SiC, and beta -SiC
    • DOI 10.1016/0038-1098(88)90562-5
    • K Nath AB Anderson 1988 Solid State Commun 66 277 10.1016/0038-1098(88) 90562-5 1:CAS:528:DyaL1cXlt1Sjsbg%3D (Pubitemid 18617758)
    • (1988) Solid State Communications , vol.66 , Issue.3 , pp. 277-280
    • Nath, K.1    Anderson Alfred, B.2
  • 39
    • 67649134987 scopus 로고    scopus 로고
    • 10.1016/j.actamat.2009.04.038 1:CAS:528:DC%2BD1MXnslKntrk%3D
    • S Ganeshan SL Shang Y Wang ZK Liu 2009 Acta Mater 57 3876 10.1016/j.actamat.2009.04.038 1:CAS:528:DC%2BD1MXnslKntrk%3D
    • (2009) Acta Mater , vol.57 , pp. 3876
    • Ganeshan, S.1    Shang, S.L.2    Wang, Y.3    Liu, Z.K.4
  • 40
    • 0019539294 scopus 로고
    • 10.1002/pssb.2221040131 1:CAS:528:DyaL3MXhs1Grur0%3D
    • T Soma 1981 Phys Status Solidi (b) 104 293 10.1002/pssb.2221040131 1:CAS:528:DyaL3MXhs1Grur0%3D
    • (1981) Phys Status Solidi (B) , vol.104 , pp. 293
    • Soma, T.1
  • 42
    • 42049089770 scopus 로고    scopus 로고
    • 2Ge compounds from first-principles calculations
    • DOI 10.1016/j.commatsci.2007.08.018, PII S0927025607002698
    • J Tani H Kido 2008 Comput Mater Sci 42 531 10.1016/j.commatsci.2007.08. 018 1:CAS:528:DC%2BD1cXkvV2ku78%3D (Pubitemid 351522444)
    • (2008) Computational Materials Science , vol.42 , Issue.3 , pp. 531-536
    • Tani, J.-i.1    Kido, H.2
  • 43
    • 77953162781 scopus 로고    scopus 로고
    • 10.1016/j.jallcom.2010.01.134 1:CAS:528:DC%2BC3cXlvVWqsL0%3D
    • H Wang H Jin W Chu Y Guo 2010 J Alloys Compd 499 68 10.1016/j.jallcom. 2010.01.134 1:CAS:528:DC%2BC3cXlvVWqsL0%3D
    • (2010) J Alloys Compd , vol.499 , pp. 68
    • Wang, H.1    Jin, H.2    Chu, W.3    Guo, Y.4
  • 44
    • 1842419247 scopus 로고
    • 10.1103/PhysRev.130.2248 1:CAS:528:DyaF3sXktVKltL4%3D
    • D Mcwilliams DW Lynch 1963 Phys Rev 130 2248 10.1103/PhysRev.130.2248 1:CAS:528:DyaF3sXktVKltL4%3D
    • (1963) Phys Rev , vol.130 , pp. 2248
    • McWilliams, D.1    Lynch, D.W.2
  • 48
    • 74249112185 scopus 로고    scopus 로고
    • 10.1016/j.calphad.2009.08.004 1:CAS:528:DC%2BD1MXhsVyjtbrP
    • X Yuan W Sun Y Du D Zhao H Yang 2009 CALPHAD 33 673 10.1016/j.calphad. 2009.08.004 1:CAS:528:DC%2BD1MXhsVyjtbrP
    • (2009) CALPHAD , vol.33 , pp. 673
    • Yuan, X.1    Sun, W.2    Du, Y.3    Zhao, D.4    Yang, H.5
  • 54
    • 0037760800 scopus 로고
    • 10.1016/0038-1098(66)90457-1 1:CAS:528:DyaF28XktlKqt7w%3D
    • HJ Caulfield DE Hudson 1966 Solid State Commun 4 299 10.1016/0038- 1098(66)90457-1 1:CAS:528:DyaF28XktlKqt7w%3D
    • (1966) Solid State Commun , vol.4 , pp. 299
    • Caulfield, H.J.1    Hudson, D.E.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.