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Showing 2013 · cond-mat.mtrl-sciShow all
2 papers · 2 filters
cond-mat.mtrl-sci2013★ 62 cited
Prediction of stable hafnium carbides: their stoichiometries, mechanical properties, and electronic structure
Qingfeng Zeng, Junhui Peng, Artem R. Oganov +6
Hafnium carbides are studied by a systematic search for possible stable stoichiometric compounds in the Hf-C system at ambient pressure using variable-composition ab initio evoluti…
cond-mat.mtrl-sci2013★ 5 cited
Evolutionary search for new high-k dielectric materials: methodology and applications to hafnia-based oxides
Qingfeng Zeng, Artem R. Oganov, Andriy O. Lyakhov +6
High-k dielectric materials are important as gate oxides in microelectronics and as potential dielectrics for capacitors. In order to enable computational discovery of novel high-k…