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Volumn 11, Issue 1, 2006, Pages 1-11

Space-time multiresolution atomistic visualization of MgO and MgSiO3 liquid data

Author keywords

Cluster analysis; First principles molecular dynamics; Mantle minerals; Scientific visualization; Silicate liquids; Space time dataset

Indexed keywords

CLUSTER ANALYSIS; CRYSTAL STRUCTURE; MOLECULAR ANALYSIS; SILICATE MINERAL; VISUALIZATION;

EID: 33846077223     PISSN: 16102924     EISSN: None     Source Type: Journal    
DOI: 10.1007/s10069-006-0003-y     Document Type: Article
Times cited : (10)

References (25)
  • 1
    • 27744444567 scopus 로고    scopus 로고
    • Melting curve of MgO from first principles simulations
    • Art. No. 235701
    • Alfe D (2005) Melting curve of MgO from first principles simulations. Phys Rev Lett 94:ARt. No. 235701
    • (2005) Phys Rev Lett , vol.94
    • Alfe, D.1
  • 4
    • 0344362023 scopus 로고
    • Structural effects of three-body interactions on atomic microclusters
    • Blaisten-Barojas E (1984) Structural effects of three-body interactions on atomic microclusters. Kinam 6A:71
    • (1984) Kinam , vol.6 A , pp. 71
    • Blaisten-Barojas, E.1
  • 6
    • 10644250257 scopus 로고
    • Inhomogeneous electron gas
    • Hohenberg P, Kohn W (1964) Inhomogeneous electron gas. Phys Rev B 136:864-871
    • (1964) Phys Rev B , vol.136 , pp. 864-871
    • Hohenberg, P.1    Kohn, W.2
  • 7
    • 0000494238 scopus 로고
    • Molecular dynamics study of melting and freezing of small Lennard-Jones clusters
    • Honeycutt JD, Andersen HC (1987) Molecular dynamics study of melting and freezing of small Lennard-Jones clusters. J Phys Chem 91:4950-4963
    • (1987) J Phys Chem , vol.91 , pp. 4950-4963
    • Honeycutt, J.D.1    Andersen, H.C.2
  • 10
    • 0015680655 scopus 로고
    • Clustering using a similarity measure based on shared near neighbors
    • Jarvis RA, Patrick EA (1973) Clustering using a similarity measure based on shared near neighbors. IEEE Trans Comp C-22:615-624
    • (1973) IEEE Trans Comp , vol.C-22 , pp. 615-624
    • Jarvis, R.A.1    Patrick, E.A.2
  • 11
    • 33646553374 scopus 로고    scopus 로고
    • First-principles calculations of structural, dynamical and electronic properties of liquid MgO
    • (in press)
    • Karki BB, Bhattarai D, Stixrude L (2006) First-principles calculations of structural, dynamical and electronic properties of liquid MgO. Phys Rev B (in press)
    • (2006) Phys Rev B
    • Karki, B.B.1    Bhattarai, D.2    Stixrude, L.3
  • 12
    • 0042113153 scopus 로고
    • Self-consistent equations including exchange and correlation effects
    • Kohn W, Sham L (1965) Self-consistent equations including exchange and correlation effects. Phys Rev A 140:1133-1138
    • (1965) Phys Rev A , vol.140 , pp. 1133-1138
    • Kohn, W.1    Sham, L.2
  • 13
    • 0033497492 scopus 로고    scopus 로고
    • XcrysDen-a new program for displaying crystalline structures and electron densities
    • Kokaji A (1999) XcrysDen-a new program for displaying crystalline structures and electron densities. J Mol Model 17:176-179
    • (1999) J Mol Model , vol.17 , pp. 176-179
    • Kokaji, A.1
  • 14
    • 0141991888 scopus 로고    scopus 로고
    • Computer graphics and graphical user interfaces as tools in simulations of matter at the atomic scale
    • Kokaji A (2003) Computer graphics and graphical user interfaces as tools in simulations of matter at the atomic scale. Comput Mater Sci 2:155-168
    • (2003) Comput Mater Sci , vol.2 , pp. 155-168
    • Kokaji, A.1
  • 15
    • 0026244229 scopus 로고
    • Molscript - A program to produce both detailed and schematic picts of protein structures
    • Kraulis PJ (1991) Molscript - a program to produce both detailed and schematic picts of protein structures. J Appl Crystallogr 24:946-950
    • (1991) J Appl Crystallogr , vol.24 , pp. 946-950
    • Kraulis, P.J.1
  • 16
    • 0030190741 scopus 로고    scopus 로고
    • Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
    • Kresse G, Furthmuller J (1996) Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Comput Mater Sci 6:15-50
    • (1996) Comput Mater Sci , vol.6 , pp. 15-50
    • Kresse, G.1    Furthmuller, J.2
  • 17
    • 33846107911 scopus 로고    scopus 로고
    • Atomistic visualization
    • In: Yip S (ed) Springer, Berlin Heidelberg New York
    • Li J (2005) Atomistic visualization. In: Yip S (ed) Handbook materials modeling. Springer, Berlin Heidelberg New York, pp 1051-1068
    • (2005) Handbook Materials Modeling , pp. 1051-1068
    • Li, J.1
  • 19
    • 3343022873 scopus 로고    scopus 로고
    • 3 in Earth's D layer
    • 3 in Earth's D layer. Nature 430:445-448
    • (2004) Nature , vol.430 , pp. 445-448
    • Oganov, A.R.1    Ono, S.2
  • 20
    • 33845267905 scopus 로고
    • Quadratic elongation - Quantitative measure of distribution in coordination polyhedra
    • Robinson K, Gibbs GV, Ribbe PH (1971) Quadratic elongation - quantitative measure of distribution in coordination polyhedra. Science 172:567-570
    • (1971) Science , vol.172 , pp. 567-570
    • Robinson, K.1    Gibbs, G.V.2    Ribbe, P.H.3
  • 24
    • 0001559982 scopus 로고
    • Crystal structure-physical property relationships in perovskites
    • Thomas NW (1989) Crystal structure-physical property relationships in perovskites. Acta Crystallogr B 45:337-344
    • (1989) Acta Crystallogr B , vol.45 , pp. 337-344
    • Thomas, N.W.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.