国家/地区 China（4）
关键词 DENSITY FUNCTIONAL THEORY（7）
出版物 MOLECULES（7）
出版时间 2019（2） 2023（2）
机构
作者

Li and Na Adsorption on Graphene and Graphene Oxide Examined by Density Functional Theory, Quantum Theory of Atoms in Molecules, and Electron Localization Function

MOLECULES

DIMAKIS N, SALAS I, GONZALEZ L, VADODARIA O, RUIZ K, BHATTI MI

First-Principles Study of the Reaction between Fluorinated Graphene and Ethylenediamine

MOLECULES

TIAN J, CHEN YH, WANG J, LIU TT, ZHANG ML, ZHANG CR

The Interactions of Oxygen with Small Gold Clusters on Nitrogen-Doped Graphene

MOLECULES

CHEN X, SUN SR, LI F, WANG XY, XIA DG

Platinum Clusters on Vacancy-Type Defects of Nanometer-Sized Graphene Patches

MOLECULES

YUMURA T, AWANO T, KOBAYASHI H, YAMABE T

Transition Metal Sensing with Nitrogenated Holey Graphene: A First-Principles Investigation

MOLECULES

SOHAIL U, ULLAH F, ARFAN NHBZ, HAMID MHSA, MAHMOOD T, SHEIKH NS, AYUB K

Regulating the Electronic Structure of Freestanding Graphene on SiC by Ge/Sn Intercalation: A Theoretical Study

MOLECULES

LUO XY, LIANG GJ, LI YL, YU FP, ZHAO X

Role of Peripheral Coordination Boron in Electrocatalytic Nitrogen Reduction over N-Doped Graphene-Supported Single-Atom Catalysts

MOLECULES

MA RJ, WENG XT, LIN LH, ZHAO J, WEI FF, LIN S