Physical Review · 1953 · 208 citations · 15 references
Natural SciencesChemistryPhysicsComputational ChemistryCondensed Matter PhysicsPhysical ChemistryAb Initio MethodsBorn-oppenheimer ApproximationDensity Functional TheoryInteratomic PotentialsMetalsTransition Metal ChemistryActivation EnergyActivation Energy DeterminationElectronic Structure Of Metal ComplexesInteratomic Potential ModelsInterstitialsModel Uncertainty
Calculation of the energies of interstitial atoms in copper have been carried through in some detail using a free-electron model and approximating the repulsion of closed shells with a Born-Mayer potential. Alternate choices of constants in this potential have been employed to explore the extent of the associated uncertainty. Results show that interstitials require an activation energy of about \textonequarter{} ev or less for motion. Applications to various current experiments are pointed out.
15
Theory of the Work Function. II. The Surface Double Layer
John Bardeen · Physical Review · 1936 · 516 citations
Natural Sciences, Chemistry, Physics +17
Mechanism for Self-Diffusion in Metallic Copper
H. B. Huntington, Frederick Seitz · Physical Review · 1942 · 295 citations