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20102023
most citedImproved self-energy correction method for accurate and efficient band structure calculation

124 citations · 496 across the 13 of their papers we have counts for

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cond-mat.mtrl-sci2015★ 52 cited

Pressure induced novel compounds in the Hf-O system from first-principles calculations

Jin Zhang, Artem R. Oganov, Xinfeng Li +3

Using first-principles evolutionary simulations, we have systematically investigated phase stability in the Hf-O system at pressure up to 120 GPa. New compounds Hf5O2, Hf3O2, HfO a…