메뉴 건너뛰기




Volumn 22, Issue 29, 2010, Pages

Ab initio lattice stability of fcc and hcp Fe-Mn random alloys

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; AB INITIO CALCULATIONS; ANTIFERROMAGNETIC ORDERINGS; ANTIFERROMAGNETIC ORDERS; ANTIFERROMAGNETICS; CALPHAD APPROACH; COMPOSITION RANGES; CROSS-OVER; DEFORMATION MECHANISM; FACE-CENTRED CUBIC; FCC ALLOYS; FCC PHASE; FE-MN ALLOY; HCP ALLOYS; HEXAGONAL CLOSE PACKED; LATTICE STABILITY; LOCAL MOMENTS; MAGNETIC CONFIGURATION; MN CONTENT; RANDOM ALLOY; ROOM TEMPERATURE; STABILIZING EFFECTS; THERMODYNAMIC CALCULATIONS; TOTAL ENERGY; TOTAL ENERGY DIFFERENCES;

EID: 77954319066     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/22/29/295402     Document Type: Article
Times cited : (38)

References (45)
  • 1
    • 0037952802 scopus 로고    scopus 로고
    • Supra-ductile and high-strength manganese-TRIP/TWIP steels for high energy absorption purposes
    • Frommeyer G, Brux U and Neumann P 2003 Supra-ductile and high-strength manganese-TRIP/TWIP steels for high energy absorption purposes ISIJ Int. 43 438-46
    • (2003) ISIJ Int. , vol.43 , Issue.3 , pp. 438-446
    • Frommeyer, G.1    Brux, U.2    Neumann, P.3
  • 2
    • 0037954904 scopus 로고    scopus 로고
    • High strength Fe-Mn-(Al, Si) TRIP/TWIP steels development-properties- application
    • Grassel O, Kruger L, Frommeyer G and Meyer L W 2000 High strength Fe-Mn-(Al, Si) TRIP/TWIP steels development-properties-application Int. J. Plast. 16 1391-409
    • (2000) Int. J. Plast. , vol.16 , Issue.10-11 , pp. 1391-1409
    • Grassel, O.1    Kruger, L.2    Frommeyer, G.3    Meyer, L.W.4
  • 3
    • 0036601121 scopus 로고    scopus 로고
    • Development and characterization of high strength impact resistant Fe-Mn-(Al-, Si) TRIP/TWIP steels
    • Brux U, Frommeyer G, Grassel O, Meyer L W and Weise A 2002 Development and characterization of high strength impact resistant Fe-Mn-(Al-, Si) TRIP/TWIP steels Steel Res. 73 294-8
    • (2002) Steel Res. , vol.73 , pp. 294-298
    • Brux, U.1    Frommeyer, G.2    Grassel, O.3    Meyer, L.W.4    Weise, A.5
  • 4
    • 10444219512 scopus 로고    scopus 로고
    • Correlations between the calculated stacking fault energy and the plasticity mechanisms in Fe-Mn-C alloys
    • Allain S, Chateau J P, Bouaziz O, Migot S and Guelton N 2004 Correlations between the calculated stacking fault energy and the plasticity mechanisms in Fe-Mn-C alloys Mater. Sci. Eng. A 387 158-62
    • (2004) Mater. Sci. Eng. , vol.387-389 , pp. 158-162
    • Allain, S.1    Chateau, J.P.2    Bouaziz, O.3    Migot, S.4    Guelton, N.5
  • 5
    • 72149132034 scopus 로고    scopus 로고
    • Derivation and variation in composition-dependent stacking fault energy maps based on subregular solution model in high-manganese steels
    • Saeed-Akbari A, Imlau J, Prahl U and Bleck W 2009 Derivation and variation in composition-dependent stacking fault energy maps based on subregular solution model in high-manganese steels Metall. Mater. Trans. A 40 3076-90
    • (2009) Metall. Mater. Trans. , vol.40 , Issue.13 , pp. 3076-3090
    • Saeed-Akbari, A.1    Imlau, J.2    Prahl, U.3    Bleck, W.4
  • 7
    • 51649178907 scopus 로고
    • General mechanism of martensitic nucleation: I. General concepts and transformation
    • Olson G B and Cohen M 1976 General mechanism of martensitic nucleation: I. General concepts and transformation Metall. Trans. A 7 1897-904
    • (1976) Metall. Trans. , vol.7 , pp. 1897-1904
    • Olson, G.B.1    Cohen, M.2
  • 11
    • 4244052698 scopus 로고
    • Crystal structure from one-electron theory
    • Skriver H L 1985 Crystal structure from one-electron theory Phys. Rev. B 31 1909-23
    • (1985) Phys. Rev. , vol.31 , Issue.4 , pp. 1909-1923
    • Skriver, H.L.1
  • 14
    • 0028767876 scopus 로고
    • Anomalous temperature behavior of the elastic-constants of antiferromagnetic Mn-invar alloys
    • Kawald U, Mitze O, Bach H, Pelzl J and Saunders G A 1994 Anomalous temperature behavior of the elastic-constants of antiferromagnetic Mn-invar alloys J. Phys.: Condens. Matter 6 9697-706
    • (1994) J. Phys.: Condens. Matter , vol.6 , Issue.45 , pp. 9697-9706
    • Kawald, U.1    Mitze, O.2    Bach, H.3    Pelzl, J.4    Saunders, G.A.5
  • 15
    • 0000446294 scopus 로고
    • Antiferromagnetism of gamma iron manganes alloys
    • Endoh Y and Ishikawa Y 1971 Antiferromagnetism of gamma iron manganes alloys J. Phys. Soc. Japan 30 1614-27
    • (1971) J. Phys. Soc. Japan , vol.30 , Issue.6 , pp. 1614-1627
    • Endoh, Y.1    Ishikawa, Y.2
  • 16
    • 0023366299 scopus 로고
    • Electronic-structure of fcc Fe-Mn alloys: II. Spin-density measurements
    • Bisanti P, Mazzone G and Sacchetti F 1987 Electronic-structure of fcc Fe-Mn alloys: II. Spin-density measurements J. Phys. F: Met. Phys. 17 1425-35 (Pubitemid 17621300)
    • (1987) Journal of physics F. Metal physics , vol.17 , Issue.6 , pp. 1425-1435
    • Bisanti, P.1    Mazzone, G.2    Sacchetti, F.3
  • 17
    • 0000783610 scopus 로고    scopus 로고
    • Noncollinear magnetism in substitutionally disordered face-centered-cubic FeMn
    • Schulthess T C, Butler W H, Stocks G M, Maat S and Mankey G J 1999 Noncollinear magnetism in substitutionally disordered face-centered-cubic FeMn J. Appl. Phys. 85 4842-4
    • (1999) J. Appl. Phys. , vol.85 , Issue.8 , pp. 4842-4844
    • Schulthess, T.C.1    Butler, W.H.2    Stocks, G.M.3    Maat, S.4    Mankey, G.J.5
  • 18
    • 4243244428 scopus 로고    scopus 로고
    • Magnetic structures in ordered and disordered gamma-FeMn alloys: Ordering due to disorder
    • Spisak D and Hafner J 2000 Magnetic structures in ordered and disordered gamma-FeMn alloys: ordering due to disorder Phys. Rev. B 61 11569-75
    • (2000) Phys. Rev. , vol.61 , Issue.17 , pp. 11569-11575
    • Spisak, D.1    Hafner, J.2
  • 20
    • 0028375826 scopus 로고
    • A review on the martensitic-transformation and shape-memory effect in Fe-Mn-Si alloys
    • Gu Q, Vanhumbeeck J and Delaey L 1994 A review on the martensitic-transformation and shape-memory effect in Fe-Mn-Si alloys J. Physique 4 135-44
    • (1994) J. Physique , vol.4 , pp. 135-144
    • Gu, Q.1    Vanhumbeeck, J.2    Delaey, L.3
  • 21
    • 0032120967 scopus 로고    scopus 로고
    • Fe-57 Mossbauer study of gamma-FeMn and epsilon-FeMn alloys
    • Kinomura T, Nasu S and Tomota Y 1998 Fe-57 Mossbauer study of gamma-FeMn and epsilon-FeMn alloys J. Japan. Inst. Met. 62 635-41
    • (1998) J. Japan. Inst. Met. , vol.62 , Issue.7 , pp. 635-641
    • Kinomura, T.1    Nasu, S.2    Tomota, Y.3
  • 24
    • 0034906979 scopus 로고    scopus 로고
    • Total-energy method based on the exact muffin-tin orbitals theory
    • Vitos L 2001 Total-energy method based on the exact muffin-tin orbitals theory Phys. Rev. B 64 014107
    • (2001) Phys. Rev. , vol.64 , Issue.1 , pp. 014107
    • Vitos, L.1
  • 25
    • 0002091571 scopus 로고    scopus 로고
    • Application of the exact muffin-tin orbitals theory: The spherical cell approximation
    • Vitos L, Skriver H L, Johansson B and Kollar J 2000 Application of the exact muffin-tin orbitals theory: the spherical cell approximation Comput. Mater. Sci. 18 24-38
    • (2000) Comput. Mater. Sci. , vol.18 , Issue.1 , pp. 24-38
    • Vitos, L.1    Skriver, H.L.2    Johansson, B.3    Kollar, J.4
  • 26
    • 4243943295 scopus 로고    scopus 로고
    • Generalized gradient approximation made simple
    • Perdew J P, Burke K and Ernzerhof M 1996 Generalized gradient approximation made simple Phys. Rev. Lett. 77 3865-8
    • (1996) Phys. Rev. Lett. , vol.77 , Issue.18 , pp. 3865-3868
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 27
    • 43049128830 scopus 로고    scopus 로고
    • Configurational thermodynamics of alloys from first principles: Effective cluster interactions
    • Ruban A V and Abrikosov I A 2008 Configurational thermodynamics of alloys from first principles: effective cluster interactions Rep. Prog. Phys. 71 046501
    • (2008) Rep. Prog. Phys. , vol.71 , Issue.4 , pp. 046501
    • Ruban, A.V.1    Abrikosov, I.A.2
  • 28
    • 36049055284 scopus 로고
    • Coherent-potential model of substitutional disordered alloys
    • Soven P 1967 Coherent-potential model of substitutional disordered alloys Phys. Rev. 156 809-13
    • (1967) Phys. Rev. , vol.156 , Issue.3 , pp. 809-813
    • Soven, P.1
  • 29
    • 42749099134 scopus 로고    scopus 로고
    • Anisotropic lattice distortions in random alloys from first-principles theory
    • Vitos L, Abrikosov I A and Johansson B 2001 Anisotropic lattice distortions in random alloys from first-principles theory Phys. Rev. Lett. 87 156401
    • (2001) Phys. Rev. Lett. , vol.87 , Issue.15 , pp. 156401
    • Vitos, L.1    Abrikosov, I.A.2    Johansson, B.3
  • 31
    • 0024703282 scopus 로고
    • An assessment of th Fe-Mn system
    • Huang W M 1989 An assessment of th Fe-Mn system Calphad 13 243-52
    • (1989) Calphad , vol.13 , Issue.3 , pp. 243-252
    • Huang, W.M.1
  • 32
    • 0035325621 scopus 로고    scopus 로고
    • Lattice parameters of metastable structures in quenched Fe-Mn alloys. Part II: Hcp phase
    • Marinelli P, Baruj A, Guillermet A F and Sade M 2001 Lattice parameters of metastable structures in quenched Fe-Mn alloys. Part II: hcp phase Z. Metallkd. 92 489-93
    • (2001) Z. Metallkd. , vol.92 , Issue.5 , pp. 489-493
    • Marinelli, P.1    Baruj, A.2    Guillermet, A.F.3    Sade, M.4
  • 33
    • 0034428633 scopus 로고    scopus 로고
    • Lattice parameters of metastable structures in quenched Fe-Mn alloys. Part I: Experimental techniques, bcc and fcc phases
    • Marinelli P, Baruj A, Guillermet A F and Sade M 2000 Lattice parameters of metastable structures in quenched Fe-Mn alloys. Part I: experimental techniques, bcc and fcc phases Z. Metallkd. 91 957-62
    • (2000) Z. Metallkd. , vol.91 , Issue.11 , pp. 957-962
    • Marinelli, P.1    Baruj, A.2    Guillermet, A.F.3    Sade, M.4
  • 34
    • 33846786573 scopus 로고    scopus 로고
    • Temperature-induced longitudinal spin fluctuations in Fe and Ni
    • Ruban A V, Khmelevskyi S, Mohn P and Johansson B 2007 Temperature-induced longitudinal spin fluctuations in Fe and Ni Phys. Rev. B 75 054402
    • (2007) Phys. Rev. , vol.75 , Issue.5 , pp. 054402
    • Ruban, A.V.1    Khmelevskyi, S.2    Mohn, P.3    Johansson, B.4
  • 35
    • 0000809086 scopus 로고    scopus 로고
    • A molecular dynamics approach to magnetic alloys with turbulent complex magnetic structures: Gamma-FeMn alloys
    • Akbar S, Kakehashi Y and Kimura N 1998 A molecular dynamics approach to magnetic alloys with turbulent complex magnetic structures: gamma-FeMn alloys J. Phys.: Condens. Matter 10 2081-105
    • (1998) J. Phys.: Condens. Matter , vol.10 , Issue.9 , pp. 2081-2105
    • Akbar, S.1    Kakehashi, Y.2    Kimura, N.3
  • 36
    • 0034365679 scopus 로고    scopus 로고
    • First-principles study on the non-collinear magnetic structures of disordered alloys
    • Sakuma A 2000 First-principles study on the non-collinear magnetic structures of disordered alloys J. Phys. Soc. Japan 69 3072-83
    • (2000) J. Phys. Soc. Japan , vol.69 , Issue.9 , pp. 3072-3083
    • Sakuma, A.1
  • 38
    • 84964568696 scopus 로고
    • Einfluß der Stapelfehlerenergie auf den kristallographischen Umgitterungsmechanismus der gamma/alpha-Umwandlung in hochlegierten Stählen
    • Schumann H 1974 Einfluß der Stapelfehlerenergie auf den kristallographischen Umgitterungsmechanismus der gamma/alpha-Umwandlung in hochlegierten Stählen Krist. Tech. 9 1141-52
    • (1974) Krist. Tech. , vol.9 , Issue.10 , pp. 1141-1152
    • Schumann, H.1
  • 39
    • 0033908633 scopus 로고    scopus 로고
    • Driving force for martensitic transformation and stacking fault energy of gamma in Fe-Mn binary system
    • Lee Y K and Choi C S 2000 Driving force for martensitic transformation and stacking fault energy of gamma in Fe-Mn binary system Metall. Mater. Trans. A 31 355-60
    • (2000) Metall. Mater. Trans. , vol.31 , Issue.2 , pp. 355-360
    • Lee, Y.K.1    Choi, C.S.2
  • 40
    • 0018479990 scopus 로고
    • Phase-transformation in high manganese-iron alloys
    • Gartstein E and Rabinkin A 1979 phase-transformation in high manganese-iron alloys Acta Metall. 27 1053-64
    • (1979) Acta Metall. , vol.27 , Issue.6 , pp. 1053-1064
    • Gartstein, E.1    Rabinkin, A.2
  • 42
    • 67650119298 scopus 로고    scopus 로고
    • Elastic constants and anisotropy in FeNi alloys at high pressures from first-principles calculations
    • Asker C, Vitos L and Abrikosov I A 2009 Elastic constants and anisotropy in FeNi alloys at high pressures from first-principles calculations Phys. Rev. B 79 214112
    • (2009) Phys. Rev. , vol.79 , Issue.21 , pp. 214112
    • Asker, C.1    Vitos, L.2    Abrikosov, I.A.3
  • 43
    • 4244122835 scopus 로고    scopus 로고
    • Elastic property maps of austenitic stainless steels
    • Vitos L, Korzhavyi P A and Johansson B 2002 Elastic property maps of austenitic stainless steels Phys. Rev. Lett. 88 055501
    • (2002) Phys. Rev. Lett. , vol.88 , Issue.15 , pp. 155501
    • Vitos, L.1    Korzhavyi, P.A.2    Johansson, B.3
  • 44
    • 0037265820 scopus 로고    scopus 로고
    • Stainless steel optimization from quantum mechanical calculations
    • Vitos L, Korzhavyi P A and Johansson B 2003 Stainless steel optimization from quantum mechanical calculations Nat. Mater. 2 25-8
    • (2003) Nat. Mater. , vol.2 , Issue.1 , pp. 25-28
    • Vitos, L.1    Korzhavyi, P.A.2    Johansson, B.3
  • 45
    • 33746008241 scopus 로고    scopus 로고
    • Alloying effects on the stacking fault energy in austenitic stainless steels from first-principles theory
    • Vitos L, Nilsson J O and Johansson B 2006 Alloying effects on the stacking fault energy in austenitic stainless steels from first-principles theory Acta Mater. 54 3821-6
    • (2006) Acta Mater. , vol.54 , Issue.14 , pp. 3821-3826
    • Vitos, L.1    Nilsson, J.O.2    Johansson, B.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.