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关键词 AB INITIO（2）
出版物 COMPUTATIONAL MATERIALS SCIENCE（2）
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Hydrogen storage in Al and Ti dispersed on graphene with boron substitution: First-principles calculations

COMPUTATIONAL MATERIALS SCIENCE

PARK HL, CHUNG YC

Assessment of approaches for dispersive forces employing semihydrogenated graphene as a case study

COMPUTATIONAL MATERIALS SCIENCE

BIROWSKA M, MARCHWIANY ME, DRAXL C, MAJEWSKI JA