国家/地区 Russia（2）
关键词 FIRSTPRINCIPLES CALCULATION（2）
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Graphene-like titanium carbides and nitrides Tin+1Cn, Tin+1Nn (n=1, 2, and 3) from de-intercalated MAX phases: First-principles probing of their structural, electronic properties and relative stability

COMPUTATIONAL MATERIALS SCIENCE

SHEIN IR, IVANOVSKII AL

Chemisorption of hydrogen atoms and hydroxyl groups on stretched graphene: A coupled QM/QM study

PHYSICS LETTERS A

KATIN KP, PRUDKOVSKIY VS, MASLOV MM