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Investigation of new phases in the Ba-Si phase diagram under high pressure using ab initio structural search

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https://hal-univ-lyon1.archives-ouvertes.fr/hal-02289448
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Submitted on : Monday, September 16, 2019 - 5:01:06 PM
Last modification on : Thursday, April 2, 2020 - 10:48:05 AM

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Jingming Shi, Wenwen Cui, Jose A. Flores-Livas, Alfonso San-Miguel, Silvana Botti, et al.. Investigation of new phases in the Ba-Si phase diagram under high pressure using ab initio structural search. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2016, 18, pp.8108-8114. ⟨10.1039/c5cp07962d⟩. ⟨hal-02289448⟩

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