Abstract. We demonstrate quantitative methods for estimating that part of the elastic interaction energy between defects in solids which does not depend on the precise spatial arrangement of the defects. This energy involves both the total volume change per defect in the finite solid and the purely shear part of the volume change. Several different continuum and atomistic modelling methods are used to calculate these volume changes for H in Pd. V, Nb and Ta. An estimate of the configuration-independent elastic interaction energy is made for the Pd-H system as a function of the H concentration, and is given in a form suitable for comparison with statistical models. 1
L'application de la méthode de Hartree et de la théorie des pseudo-potentiels permet d'écrire l'éner...
A method of determining the type of defect present in nonstoichiometric transition metal hydrides is...
It is shown that the interaction energy of two defects in a metal can be computed consistently from ...
We study the statistical mechanics.of hydrogen dissolved in metals. The underlying model is based on...
Hydrogen and its isotopes, absorbed in metals, induce local stress on the atomic structure, which ge...
Modeling hydrogen-induced embrittlement in metals requires a clear understanding of the effects of h...
Several important aspects of hydrogen vacancy interaction are discussed with a physical model as wel...
Metal hydrides are of inestimable importance for the future of hydrogen energy. This unique monograp...
Using an extra-orbital model within a generalized « spd » tight-binding approximation, we calculate ...
The interaction of hydrogen with defects in palladium was studied using qualitative electronic struc...
Some issues that arise when modeling elastic energy for binary alloys are discussed within the conte...
This thesis presents a model to simulate the effects of hydrogen on the mechanical behavior of singl...
International audienceAlthough many materials are used under extreme conditions, the effects of stre...
This thesis studies metal-hydrogen systems. The interaction between hydrogen-atoms and vacancies in ...
Finite element analysis is used to study the effect of mobile interstitial hydrogen on the deformati...
L'application de la méthode de Hartree et de la théorie des pseudo-potentiels permet d'écrire l'éner...
A method of determining the type of defect present in nonstoichiometric transition metal hydrides is...
It is shown that the interaction energy of two defects in a metal can be computed consistently from ...
We study the statistical mechanics.of hydrogen dissolved in metals. The underlying model is based on...
Hydrogen and its isotopes, absorbed in metals, induce local stress on the atomic structure, which ge...
Modeling hydrogen-induced embrittlement in metals requires a clear understanding of the effects of h...
Several important aspects of hydrogen vacancy interaction are discussed with a physical model as wel...
Metal hydrides are of inestimable importance for the future of hydrogen energy. This unique monograp...
Using an extra-orbital model within a generalized « spd » tight-binding approximation, we calculate ...
The interaction of hydrogen with defects in palladium was studied using qualitative electronic struc...
Some issues that arise when modeling elastic energy for binary alloys are discussed within the conte...
This thesis presents a model to simulate the effects of hydrogen on the mechanical behavior of singl...
International audienceAlthough many materials are used under extreme conditions, the effects of stre...
This thesis studies metal-hydrogen systems. The interaction between hydrogen-atoms and vacancies in ...
Finite element analysis is used to study the effect of mobile interstitial hydrogen on the deformati...
L'application de la méthode de Hartree et de la théorie des pseudo-potentiels permet d'écrire l'éner...
A method of determining the type of defect present in nonstoichiometric transition metal hydrides is...
It is shown that the interaction energy of two defects in a metal can be computed consistently from ...