Simulation of diffusion of hydrogen atoms in the lattice of tungsten

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Abstract

Results of DFT calculations of the activation energy for diffusion and vibrational spectra of interstitial hydrogen atoms in the lattice of tungsten are presented. The temperature dependences of the diffusion coefficient are calculated and compared with experimental data.

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Degtyarenko, N. N., & Pisarev, A. A. (2016). Simulation of diffusion of hydrogen atoms in the lattice of tungsten. In Journal of Physics: Conference Series (Vol. 748). Institute of Physics Publishing. https://doi.org/10.1088/1742-6596/748/1/012010

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