1985
DOI: 10.1016/0001-6160(85)90098-7
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Dilation of h.c.p. zirconium by interstitial deuterium

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Cited by 94 publications
(29 citation statements)
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“…We analyze the approximations made by each of them, and we apply state-of-the-art density functional theory (DFT) techniques to see whether each of them can reproduce the dipole tensor for H in α-Zr deduced from experimental measurements of the λ-tensor by MacEwen et al [3]. As far as we know this is the first comparison between dipole tensor components deduced from experimental measurements of the λ-tensor and calculations from first principles.…”
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confidence: 99%
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“…We analyze the approximations made by each of them, and we apply state-of-the-art density functional theory (DFT) techniques to see whether each of them can reproduce the dipole tensor for H in α-Zr deduced from experimental measurements of the λ-tensor by MacEwen et al [3]. As far as we know this is the first comparison between dipole tensor components deduced from experimental measurements of the λ-tensor and calculations from first principles.…”
mentioning
confidence: 99%
“…MacEwen et al [3] measured changes in the lattice parameters in α-Zr as a function of interstitial deuterium concentration, at temperatures between 727 K and 777 K, using time of flight neutron diffraction. The λ-tensor is defined by λ i j = dε i j /dC D , where C D is the atomic fraction of D-atoms, and ε i j is the eigenstrain tensor caused by D-atoms.…”
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“…The numerical application of equation 13, using Q * =25 kJ/mol (Table 2) and V =1.67 cm 3 /mol [83], is displayed in Figure 13. At 375 • C, a 681 MPa/m stress gradient is equivalent to a 10 • C/m thermal gradient in terms of the contribution on hydrogen diffusion.…”
Section: Impact Of the Blister-induced Stress Field On The Hydrogen Tmentioning
confidence: 99%
“…La présence de l'hydrogène en solution conduit à une distorsion anisotrope de la maille cristalline. Cette dilatation est traduite par la variation relative des paramètres de maille a et c sous la forme : a = 1 [30] alors que pour le titane a = 0.02 et c = 0.008 [27]. Ainsi l'expansion le long de l'axe c est plus importante que selon l'axe a dans le cas du zirconium contrairement au cas du titane où c'est l'inverse.…”
Section: Solubilité Et Mobilité De L'hydrogèneunclassified