Quantum Mechanical Predictions in Intermetallics Modelling [and Discussion]
Materials modelling involves research that spans the very broad spectrum of length scales from quantum mechanical calculations at the angstrom level all the way through to finite-element or finite-difference modelling at the continuum level. This paper reviews the role that quantum mechanics plays i...
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| Veröffentlicht in: | Philosophical transactions of the Royal Society of London. Series A: Mathematical, physical, and engineering sciences physical, and engineering sciences, 1995-06, Vol.351 (1697), p.529-542 |
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| container_end_page | 542 |
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| container_issue | 1697 |
| container_start_page | 529 |
| container_title | Philosophical transactions of the Royal Society of London. Series A: Mathematical, physical, and engineering sciences |
| container_volume | 351 |
| creator | Manh, D. Nguyen Bratkovsky, A. M. Pettifor, D. G. Westwood, A. R. C. Kumar, K. S. Cahn, R. W. |
| description | Materials modelling involves research that spans the very broad spectrum of length scales from quantum mechanical calculations
at the angstrom level all the way through to finite-element or finite-difference modelling at the continuum level. This paper
reviews the role that quantum mechanics plays in the modelling hierarchy with particular reference to the titanium and nickel
aluminides. |
| doi_str_mv | 10.1098/rsta.1995.0051 |
| format | Article |
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at the angstrom level all the way through to finite-element or finite-difference modelling at the continuum level. This paper
reviews the role that quantum mechanics plays in the modelling hierarchy with particular reference to the titanium and nickel
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at the angstrom level all the way through to finite-element or finite-difference modelling at the continuum level. This paper
reviews the role that quantum mechanics plays in the modelling hierarchy with particular reference to the titanium and nickel
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| fulltext | fulltext |
| identifier | ISSN: 1364-503X |
| ispartof | Philosophical transactions of the Royal Society of London. Series A: Mathematical, physical, and engineering sciences, 1995-06, Vol.351 (1697), p.529-542 |
| issn | 1364-503X 0962-8428 1471-2962 2054-0299 |
| language | eng |
| recordid | cdi_royalsociety_journals_10_1098_rsta_1995_0051 |
| source | JSTOR Mathematics & Statistics; Jstor Complete Legacy |
| subjects | Aluminides Atoms Binding energy Electrons Ground state Intermetallics Metastable atoms Modeling Quantum mechanics Transition metals |
| title | Quantum Mechanical Predictions in Intermetallics Modelling [and Discussion] |
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