Metal-Decorated Phthalocyanine Monolayer as a Potential Gas Sensing Material for Phosgene: A First-Principles Study

Structure and surface insight into a temperature-sensitive CaO-based CO2 sorbent

(2022) Yongqing Xu et al.   CHEMICAL ENGINEERING JOURNAL

Gas sensing based on metal-organic frameworks: Concepts, functions, and developments

(2022) Rui Zhang et al.   JOURNAL OF HAZARDOUS MATERIALS

Ti, Ni, and Cu decorated borospherene as potential molecular sensor for phosgene

(2022) Kamal A. Soliman et al.   MATERIALS SCIENCE IN SEMICONDUCTOR PROCESSING

Porphyrin and phthalocyanine based covalent organic frameworks for electrocatalysis

(2022) Shengsheng Huang et al.   COORDINATION CHEMISTRY REVIEWS

Principles for designing CO2 adsorption catalyst: Serving thermal conductivity as the determinant for reactivity

(2021) Chaozheng He et al.   CHINESE CHEMICAL LETTERS

Porous α-Fe2O3 gas sensor with instantaneous attenuated response toward triethylamine and its reaction kinetics

(2021) Hong Wang et al.   CHEMICAL ENGINEERING JOURNAL

Adsorption of Phosgene Gas on Pristine and Copper-Decorated B12N12 Nanocages: A Comparative DFT Study

(2020) Shahid Hussain et al.   ACS Omega

Novel Strategy for Organic Cocrystals of n-Type and p-Type Organic Semiconductors with Advanced Optoelectronic Properties

(2020) Taoyu Zou et al.   ACS Omega

Protective role of mesenchymal stem cells transfected with miRNA-378a-5p in phosgene inhalation lung injury

(2020) Yubei Qu et al.   BIOCHEMICAL AND BIOPHYSICAL RESEARCH COMMUNICATIONS

Adsorption Property of CS2 and COF2 on Nitrogen-Doped Anatase TiO2(101) Surfaces: A DFT Study

(2020) Zhengqin Cao et al.   ACS Omega

Rh-doped h-BN monolayer as a high sensitivity SF6 decomposed gases sensor: A DFT study

(2020) Sheng-Yuan Xia et al.   APPLIED SURFACE SCIENCE

A DFT-D2 study on the adsorption of phosgene derivatives and chloromethyl chloroformate on pristine and Fe4-decorated graphene

(2020) Jogender et al.   JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Theoretical insight into two-dimensional M-Pc monolayer as an excellent material for formaldehyde and phosgene sensing

(2020) Huihui Xiong et al.   APPLIED SURFACE SCIENCE

Adsorption of phosgene on Si-embedded MoS2 sheet and electric field-assisted desorption: insights from DFT calculations

(2019) Archana Sharma et al.   JOURNAL OF MATERIALS SCIENCE

CrI3-WTe2: A Novel Two-Dimensional Heterostructure as Multisensor for BrF3 and COCL2 Toxic Gases

(2019) Amreen Bano et al.   Scientific Reports

Synergistic Catalysis over Iron‐Nitrogen Sites Anchored with Cobalt Phthalocyanine for Efficient CO 2 Electroreduction

(2019) Long Lin et al.   ADVANCED MATERIALS

C2N monolayer as NH3 and NO sensors: A DFT study

(2019) Yongliang Yong et al.   APPLIED SURFACE SCIENCE

Effects of gas adsorption on electronic and optical properties of palladium-doped graphene: First-principles study

(2019) Jian-Ning Zhang et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES

Effect of lignin, cellulose and hemicellulose on calcium looping behavior of CaO-based sorbents derived from extrusion-spherization method

(2018) Yongqing Xu et al.   CHEMICAL ENGINEERING JOURNAL

A new flatland buddy as toxic gas scavenger: A first principles study

(2018) Khushboo Patel et al.   JOURNAL OF HAZARDOUS MATERIALS

Adsorption behaviour of SF6 decomposed species onto Pd4-decorated single-walled CNT: a DFT study

(2018) Hao Cui et al.   MOLECULAR PHYSICS

Controlling spin off state by gas molecules adsorption on metal-phthalocyanine molecular junctions and its possibility of gas sensor

(2018) Wenkai Zhao et al.   PHYSICS LETTERS A

Adsorption of SF6 decomposition components on Pt3-TiO2(1 0 1) surface: A DFT study

(2018) Yao Wang et al.   APPLIED SURFACE SCIENCE

A colorimetric and ratiometric fluorescent probe with ultralow detection limit and high selectivity for phosgene sensing

(2018) Peilian Liu et al.   DYES AND PIGMENTS

Two-dimensional iron-phthalocyanine (Fe-Pc) monolayer as a promising single-atom-catalyst for oxygen reduction reaction: a computational study

(2015) Yu Wang et al.   Nanoscale

Electronics based on two-dimensional materials

(2014) Gianluca Fiori et al.   Nature Nanotechnology

Copper phthalocyanine thin film transistors for hydrogen sulfide detection

(2012) Xian Li et al.   SENSORS AND ACTUATORS B-CHEMICAL

Generalized molecular orbital tomography

(2011) C. Vozzi et al.   Nature Physics

Single Layer of Polymeric Fe-Phthalocyanine: An Organometallic Sheet on Metal and Thin Insulating Film

(2010) Mathieu Abel et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Dispersion-corrected Mo̸ller–Plesset second-order perturbation theory

(2009) Alexandre Tkatchenko et al.   JOURNAL OF CHEMICAL PHYSICS

Plasma-deposited copper phthalocyanine: A single gas-sensing material with multiple responses

(2007) G. Maggioni et al.   SENSORS AND ACTUATORS B-CHEMICAL

High aspect ratio In2O3 nanowires: Synthesis, mechanism and NO2 gas-sensing properties

(2007) Pengcheng Xu et al.   SENSORS AND ACTUATORS B-CHEMICAL