Alloy Modeling & Design: Proceedings of a Symposium Sponsored by the TMS Structural Materials Division (SMD), the Committee on Alloy Phases (CAP), and the Electronic, Magnetic and Photonic Materials Division (EMPMD), the Oak Ridge National Laboratory and the Lawrence Livermore National Laboratory, Held During Materials Week '93, Pittsburgh, Pennsylvania, October 18-20, 1993G. M. Stocks, Patrice E. A. Turchi This work brings together contributions from researchers in a variety of fields that have a common interest in applying the most recent developments in basic research to the design of new alloys. The papers are from Materials Week '93 held in Pittsburgh, Pennsylvania, October 17-21, 1993. |
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Page 6
... Lattice Constants for Mg and Al α C c / a Mq ( hcp ) Theory 3.04 Å 5.20 Å 1.71 Expt 3.21 Å 5.21 Å 1.62 Al ( fcc ) Theory 3.96 Å 1.71 Expt 4.05 Å The important features of all these schemes are that one need not store the full h matrix ...
... Lattice Constants for Mg and Al α C c / a Mq ( hcp ) Theory 3.04 Å 5.20 Å 1.71 Expt 3.21 Å 5.21 Å 1.62 Al ( fcc ) Theory 3.96 Å 1.71 Expt 4.05 Å The important features of all these schemes are that one need not store the full h matrix ...
Page 36
... lattice constants for the ordered ( a . ) and the dis- ordered ( ad ) Cu - Zn , Ni - Pt , and Al - Li alloys ... constant . The Al - Li system presents a stringest test for checking the reliability of theoretical pre- dictions of lattice ...
... lattice constants for the ordered ( a . ) and the dis- ordered ( ad ) Cu - Zn , Ni - Pt , and Al - Li alloys ... constant . The Al - Li system presents a stringest test for checking the reliability of theoretical pre- dictions of lattice ...
Page 93
... lattice parameter is obtained for all the compounds . The theoretically calculated values of the lattice parameter are in good agreement with those obtained experimentally , which clearly shows that LDA works well in these compounds ...
... lattice parameter is obtained for all the compounds . The theoretically calculated values of the lattice parameter are in good agreement with those obtained experimentally , which clearly shows that LDA works well in these compounds ...
Contents
CONSEQUENCES OF OSCILLATORY POTENTIALS AND ANGULAR | 13 |
FIRSTPRINCIPLES TIGHTBINDING TOTAL ENERGY | 25 |
Contributed Papers | 33 |
Copyright | |
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Common terms and phrases
addition aging agreement alloys approach approximation atoms average band behavior binary bonding boundary calculations cell chemical cluster compared composition compounds computed concentration configuration consistent contribution correlation crystal defects density dependence described determined diffraction discussed dislocation disordered displacement distance effect elastic electronic electronic structure elements energy expansion experiment experimental FeAl Figure formation function given grain boundaries important included increase indicates interactions intermetallic lattice magnetic Materials matrix measured mechanical Metals method neighbor NiAl observed obtained occupation ordered orientation pair parameters phase diagram Phys Physics plane potential predicted present properties range References relative respectively samples scattering Science shown simulations solid solution stability Stocks strain strength stress structure surface Table techniques temperature ternary theory total energy transition vacancy vibrational volume x-ray yield
References to this book
Encyclopedia of Applied Physics, Volume 18 George L. Trigg,Eduardo S. Vera,Walter Greulich No preview available - 1997 |