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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Results 1-3 of 42
Page 9
... Formation For Al - Mg for the Ll2 ( Cu3 Au ) and Llo ( Cu Au I ) Structures . Experiment is from Ref . 23 . many ... formation energy . This was done by calculating the total energy of the defect free supercell , Eo , and the cell ...
... Formation For Al - Mg for the Ll2 ( Cu3 Au ) and Llo ( Cu Au I ) Structures . Experiment is from Ref . 23 . many ... formation energy . This was done by calculating the total energy of the defect free supercell , Eo , and the cell ...
Page 37
... formation enthalpies are also given . Equivolume E。 Charge - Neutral Ed system Ed E。 This Work -6.10 -2.42 -4.31 ... formation energy , E. , and disordered - alloy for- mation energy , Ed , for Cu - Zn , Ni - Pt , and Al - Li systems ...
... formation enthalpies are also given . Equivolume E。 Charge - Neutral Ed system Ed E。 This Work -6.10 -2.42 -4.31 ... formation energy , E. , and disordered - alloy for- mation energy , Ed , for Cu - Zn , Ni - Pt , and Al - Li systems ...
Page 103
... formation energy is +5.4 mRy from the CPA . If the newly proposed screened - CPA is used , the formation energy is found to be +5.0 mRy [ 5 ] . ( Within the muffin - tin approximation , this energy is 6.2 mRy , roughly showing the ...
... formation energy is +5.4 mRy from the CPA . If the newly proposed screened - CPA is used , the formation energy is found to be +5.0 mRy [ 5 ] . ( Within the muffin - tin approximation , this energy is 6.2 mRy , roughly showing the ...
Contents
CONSEQUENCES OF OSCILLATORY POTENTIALS AND ANGULAR | 13 |
FIRSTPRINCIPLES TIGHTBINDING TOTAL ENERGY | 25 |
Contributed Papers | 33 |
Copyright | |
29 other sections not shown
Common terms and phrases
10Ti alloy Acta Metall Al-Li Al3Ti Alloy Modeling Alloy Phase alloys annealing APB energy approximation atom probe behavior binary alloys cluster expansion composition computed configuration density Design Edited dislocation displacement ductility Edited by G.M. effect elastic constants electronic structure entropy equivolume expansion experimental FeAl Fermi energy Fermi surface Figure first-principles formation energy free energy friction stress G.M. Stocks glide plane grain boundaries Grand Potential Hamiltonian increase intermetallic compounds Ising model lattice constants lattice parameter Lett magnetic Materials Science Materials Society matrix Metals & Materials method Modeling and Design nearest neighbor Ni3Al NiAl obtained ordered P.E.A. Turchi phase diagram phase stability phonon Phys plane point defects potential predicted samples screw shown in Fig simulations solid solution Stocks and P.E.A. stoichiometry sublattice techniques ternary theory thermal tight-binding total energy transition metal trialuminides Turchi The Minerals unit cell vibrational x-ray
References to this book
Encyclopedia of Applied Physics, Volume 18 George L. Trigg,Eduardo S. Vera,Walter Greulich No preview available - 1997 |