메뉴 건너뛰기




Volumn 109, Issue 12, 2012, Pages

Better alloys with quantum design

Author keywords

[No Author keywords available]

Indexed keywords

ADHESIVE PROPERTIES; EXPERIMENTAL APPROACHES; QUANTUM DESIGNS; THEORY AND MODELING; TRIAL-AND-ERROR METHOD;

EID: 84866653665     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.109.125506     Document Type: Article
Times cited : (22)

References (22)
  • 2
    • 0035437414 scopus 로고    scopus 로고
    • 1364-2812 10.1080/13642810108216538
    • M. Eberhart, Philos. Mag. B 81, 721 (2001). 1364-2812 10.1080/13642810108216538
    • (2001) Philos. Mag. B , vol.81 , pp. 721
    • Eberhart, M.1
  • 3
    • 77951601873 scopus 로고    scopus 로고
    • IJQCB2 0020-7608 10.1002/qua.22270
    • T. Jones and M. Eberhart, Int. J. Quantum Chem. 110, 1500 (2010). IJQCB2 0020-7608 10.1002/qua.22270
    • (2010) Int. J. Quantum Chem. , vol.110 , pp. 1500
    • Jones, T.1    Eberhart, M.2
  • 4
    • 66749143541 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.3139113
    • T.E. Jones and M.E. Eberhart, J. Chem. Phys. 130, 204108 (2009). JCPSA6 0021-9606 10.1063/1.3139113
    • (2009) J. Chem. Phys. , vol.130 , pp. 204108
    • Jones, T.E.1    Eberhart, M.E.2
  • 6
    • 0028029232 scopus 로고
    • SCIEAS 0036-8075 10.1126/science.265.5170.376
    • R. Wu, A. Freeman, and G. Olson, Science 265, 376 (1994). SCIEAS 0036-8075 10.1126/science.265.5170.376
    • (1994) Science , vol.265 , pp. 376
    • Wu, R.1    Freeman, A.2    Olson, G.3
  • 7
    • 11144239754 scopus 로고    scopus 로고
    • Bismuth embrittlement of copper is an atomic size effect
    • DOI 10.1038/nature03198
    • R. Schweinfest, A. Paxton, and M. Finnis, Nature (London) 432, 1008 (2004). NATUAS 0028-0836 10.1038/nature03198 (Pubitemid 40052227)
    • (2004) Nature , vol.432 , Issue.7020 , pp. 1008-1011
    • Schweinfest, R.1    Paxton, A.T.2    Finnis, M.W.3
  • 8
    • 0034879483 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.63.165415
    • W.T. Geng, A.J. Freeman, and G.B. Olson, Phys. Rev. B 63, 165415 (2001). PRBMDO 0163-1829 10.1103/PhysRevB.63.165415
    • (2001) Phys. Rev. B , vol.63 , pp. 165415
    • Geng, W.T.1    Freeman, A.J.2    Olson, G.B.3
  • 9
    • 84977297852 scopus 로고
    • ACACEQ 0108-7673 10.1107/S0108767394003740
    • P.F. Zou and R.F.W. Bader, Acta Crystallogr. Sect. A 50, 714 (1994). ACACEQ 0108-7673 10.1107/S0108767394003740
    • (1994) Acta Crystallogr. Sect. A , vol.50 , pp. 714
    • Zou, P.F.1    Bader, R.F.W.2
  • 11
    • 0037014433 scopus 로고    scopus 로고
    • Two mechanisms of ductile fracture: Void by void growth versus multiple void interaction
    • DOI 10.1016/S0020-7683(02)00168-3, PII S0020768302001683, IUTAM Symposium Proceedings
    • V. Tvergaard and J.W. Hutchinson, Int. J. Solids Struct. 39, 3581 (2002). IJSOAD 0020-7683 10.1016/S0020-7683(02)00168-3 (Pubitemid 34801321)
    • (2002) International Journal of Solids and Structures , vol.39 , Issue.13-14 , pp. 3581-3597
    • Tvergaard, V.1    Hutchinson, J.W.2
  • 14
    • 51749098409 scopus 로고    scopus 로고
    • PRBMDO 1098-0121 10.1103/PhysRevB.78.092104
    • T.E. Jones, M.A. Sauer, and M.E. Eberhart, Phys. Rev. B 78, 092104 (2008). PRBMDO 1098-0121 10.1103/PhysRevB.78.092104
    • (2008) Phys. Rev. B , vol.78 , pp. 092104
    • Jones, T.E.1    Sauer, M.A.2    Eberhart, M.E.3
  • 15
    • 0036532268 scopus 로고    scopus 로고
    • First-principles study of metallic iron interfaces
    • DOI 10.1016/S0039-6028(01)01762-9, PII S0039602801017629
    • A. Hung, I. Yarovsky, J. Muscat, S. Russo, I. Snook, and R.O. Watts, Surf. Sci. 501, 261 (2002). SUSCAS 0039-6028 10.1016/S0039-6028(01)01762-9 (Pubitemid 34249577)
    • (2002) Surface Science , vol.501 , Issue.3 , pp. 261-269
    • Hung, A.1    Yarovsky, I.2    Muscat, J.3    Russo, S.4    Snook, I.5    Watts, R.O.6
  • 16
    • 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 and J. Furthmuller, Comput. Mater. Sci. 6, 15 (1996). CMMSEM 0927-0256 10.1016/0927-0256(96)00008-0 (Pubitemid 126412269)
    • (1996) Computational Materials Science , vol.6 , Issue.1 , pp. 15-50
    • Kresse, G.1    Furthmuller, J.2
  • 17
    • 4243943295 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865
    • J.P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996). PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 18
    • 40749099049 scopus 로고    scopus 로고
    • Topology of the spin-polarized charge density in bcc and fcc iron
    • DOI 10.1103/PhysRevLett.100.017208
    • T.E. Jones, M.E. Eberhart, and D.P. Clougherty, Phys. Rev. Lett. 100, 017208 (2008). PRLTAO 0031-9007 10.1103/PhysRevLett.100.017208 (Pubitemid 351388397)
    • (2008) Physical Review Letters , vol.100 , Issue.1 , pp. 017208
    • Jones, T.E.1    Eberhart, M.E.2    Clougherty, D.P.3
  • 20
    • 0030172043 scopus 로고    scopus 로고
    • The metallic bond: Elastic properties
    • DOI 10.1016/1359-6454(95)00347-9
    • M. Eberhart, Acta Mater. 44, 2495 (1996). ACMAFD 1359-6454 10.1016/1359-6454(95)00347-9 (Pubitemid 126356783)
    • (1996) Acta Materialia , vol.44 , Issue.6 , pp. 2495-2504
    • Eberhart, M.E.1
  • 21
    • 84866644006 scopus 로고    scopus 로고
    • See Supplemental Material at http://link.aps.org/supplemental/10.1103/ PhysRevLett.109.125506 for plots of the work of fracture versus the electron charge density at the second-neighbor Fe-Fe bond point and the Fe-C bond point in the Fe-carbide interfaces.
  • 22
    • 20644438873 scopus 로고    scopus 로고
    • Chemistry with ADF
    • DOI 10.1002/jcc.1056
    • G. te Velde, F. Bickelhaupt, E. Baerends, C.F. Guerra, S. van Ginsbergen, J. Snijders, and T. Ziegler, J. Comput. Chem. 22, 931 (2001). JCCHDD 0192-8651 10.1002/jcc.1056 (Pubitemid 32455733)
    • (2001) Journal of Computational Chemistry , vol.22 , Issue.9 , pp. 931-967
    • Bickelhaupt, F.M.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.