国家/地区 Italy（3）
关键词 DFT（3）
出版物
出版时间 2020（3）
机构
作者

H-2 Transformations on Graphene Supported Palladium Cluster: DFT-MD Simulations and NEB Calculations

CATALYSTS

FERRANTE F, PRESTIANNI A, BERTINI M, DUCA D

Unravelling electrocatalytic properties of metal porphyrin-like complexes hosted in graphene matrices

2D MATERIALS

RISPLENDI F, FIORENTIN MR, CICERO G

Quantum Mechanics/Molecular Mechanics (QM/MM) applied to tribology: Real-time monitoring of tribochemical reactions of water at graphene edges

COMPUTATIONAL MATERIALS SCIENCE

RESTUCCIA P, FERRARIO M, RIGHI MC