Adsorption of Bromonitromethane over Graphene‐Based Substrates: A Density Functional Theory Analysis

Adsorption and dissociation mechanism of SO2 and H2S on Pt decorated graphene: a DFT-D3 study

(2018) Dachang Chen et al.   APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING

Theoretical study of ozone adsorption on the surface of Fe, Co and Ni doped boron nitride nanosheets

(2018) Davood Farmanzadeh et al.   APPLIED SURFACE SCIENCE

Ni, Pd, and Pt-embedded graphitic carbon nitrides as excellent adsorbents for HCN removal: A DFT study

(2018) Hadi Basharnavaz et al.   APPLIED SURFACE SCIENCE

Transition metal (Pd, Pt, Ag, Au) decorated InN monolayer and their adsorption properties towards NO 2 : Density functional theory study

(2018) Yanhua Guo et al.   APPLIED SURFACE SCIENCE

The selective adsorption of formaldehyde and methanol over Al- or Si-decorated graphene oxide: A DFT study

(2018) Mehdi D. Esrafili et al.   JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Binding of phenolic model compounds with noble metal doped graphene sheets

(2018) Anand Mohan Verma et al.   Computational and Theoretical Chemistry

Cu, Ag and Au clusters as air pollutants hunters

(2018) Miguel Reina et al.   Computational and Theoretical Chemistry

TiO2 -Graphene Nanocomposites for Effective Photocatalytic Degradation of Rhodamine-B Dye

(2018) Raghu M. Gunnagol et al.   ChemistrySelect

First-Principles Study on the Adsorption of HF on Reduced Graphene Oxide

(2018) Meilian Zhao et al.   ChemistrySelect

Rapid and complete dehalogenation of halonitromethanes in simulated gastrointestinal tract and its influence on toxicity

(2018) Jinbao Yin et al.   CHEMOSPHERE

DFT study on the adsorption of p-nitrophenol over vacancy and Pt-doped graphene sheets

(2018) Mandeep et al.   Computational and Theoretical Chemistry

Epoxidation of ethylene over Pt-, Pd- and Ni-doped graphene in the presence of N2O as an oxidant: a comparative DFT study

(2017) Mehdi D. Esrafili et al.   NEW JOURNAL OF CHEMISTRY

Adsorption/desorption process of formaldehyde onto iron doped graphene: a theoretical exploration from density functional theory calculations

(2017) Diego Cortés-Arriagada et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

In vitro studies on the tumorigenic potential of the halonitromethanes trichloronitromethane and bromonitromethane

(2017) Alicia Marsà et al.   TOXICOLOGY IN VITRO

Enhanced interaction of nickel clusters with pyridinic-N (B) doped graphene using DFT simulation

(2017) Xuan Zhou et al.   Computational and Theoretical Chemistry

Adsorption of Various Monoterpenoids on the Surface of Graphene and Nitrogen-Doped Graphene: A DFT Based Study

(2017) Hemen Deka et al.   ChemistrySelect

Graphene and Graphene-Based Composites: A Rising Star in Water Purification - A Comprehensive Overview

(2016) Muniyappan Rajiv Gandhi et al.   ChemistrySelect

Recent progress in applications of graphene oxide for gas sensing: A review

(2015) Kei Toda et al.   ANALYTICA CHIMICA ACTA

Environmental Applications of Three-Dimensional Graphene-Based Macrostructures: Adsorption, Transformation, and Detection

(2014) Yi Shen et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Role of graphene/metal oxide composites as photocatalysts, adsorbents and disinfectants in water treatment: a review

(2013) Ravi Kant Upadhyay et al.   RSC Advances

The chemistry of graphene oxide

(2009) Daniel R. Dreyer et al.   CHEMICAL SOCIETY REVIEWS

Genotoxicity analysis of two halonitromethanes, a novel group of disinfection by-products (DBPs), in human cells treated in vitro

(2009) Danae Liviac et al.   ENVIRONMENTAL RESEARCH