Electronic Structure and PropertiesFrank Y. Fradin |
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Page 400
... vacancies has been discussed by Johnson ( 1973 ) . Recently Singhal and Callaway ( 1979 ) have attempted to calculate the energetics of the vacancy formation from first principles using band structure methods . The reader is referred to ...
... vacancies has been discussed by Johnson ( 1973 ) . Recently Singhal and Callaway ( 1979 ) have attempted to calculate the energetics of the vacancy formation from first principles using band structure methods . The reader is referred to ...
Page 415
... vacancy . Manninen and Nieminen ( 1979a ) have shown that when the latter is taken into account , it is not energetically favorable for hydrogen to be in a trapped state with the vacancy in Al . They also reached similar conclusions ...
... vacancy . Manninen and Nieminen ( 1979a ) have shown that when the latter is taken into account , it is not energetically favorable for hydrogen to be in a trapped state with the vacancy in Al . They also reached similar conclusions ...
Page 416
... VACANCY ( b ) VACANCY 9 8 0.6 1.0 ( c ) 0.9 0.8 -8688 -1.0 0.4 우성 0.2 SPIN - DEPENDENT EFFECTIVE POTENTIAL ( Ry ) , -0.2 -0.4 0.7 μ + VACANCY ( e ) VACANCY ( f ) 0.7 0.6 0.5 0.3 0.5 0.4 0.4 0.2 0.3 1 0.2 0.4 0.6 0.8 1.0 0.20 2 r ( 0 ) ...
... VACANCY ( b ) VACANCY 9 8 0.6 1.0 ( c ) 0.9 0.8 -8688 -1.0 0.4 우성 0.2 SPIN - DEPENDENT EFFECTIVE POTENTIAL ( Ry ) , -0.2 -0.4 0.7 μ + VACANCY ( e ) VACANCY ( f ) 0.7 0.6 0.5 0.3 0.5 0.4 0.4 0.2 0.3 1 0.2 0.4 0.6 0.8 1.0 0.20 2 r ( 0 ) ...
Contents
Illustrative Examples | 25 |
Photoelectron Spectroscopy as an Electronic | 99 |
Electronic Structure and the ElectronPhonon Interaction | 165 |
Copyright | |
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Electronic Structure and Properties: Treatise on Materials ..., Volume 21 Frank Y. Fradin Limited preview - 2016 |
Common terms and phrases
alloys anomalies approximation atom band structure binding energy Brillouin zone calculated charge density Chem cluster component compounds conduction electrons contribution correlation Coulomb crystal curve d band deformation potential e/at effect elastic constants electrical resistivity electron density electron gas electron-phonon interaction electronic structure energy band experiment experimental Fermi energy Fermi surface ferromagnetic Freeman Friedel Friedel oscillations Gupta hydrogen impurity increase interstitial ions jellium jellium model Jena lattice Lett magnetic Manninen matrix elements measured method moduli monovacancy muffin-tin muon N/m² Nb-Mo Nieminen obtained Papaconstantopoulos parameter peak phase phonon photoemission Phys point defects positron properties proton pseudopotential radius sample scattering self-consistent shear shift shown in Fig shows Solid State Commun spectra spin density strain superconducting temperature dependence theoretical theory tion transition metals transition-metal vacancy valence values variation velocity void volume wave functions York