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

Towards Efficient Toxic-Gas Detectors: Exploring Molecular Interactions of Sarin and Dimethyl Methylphosphonate With Metal-Centered Phthalocyanine Structures

(2020) Hazem Aldahhak et al.   Journal of Physical Chemistry C

Highly sensitive and selective sensing of acetone and hydrogen sulfide using metal phthalocyanine – carbon nanotube hybrids

(2020) Jariyanee Prasongkit et al.   APPLIED SURFACE SCIENCE

A first-principles study of doped black phosphorus carbide monolayers as NO2 and NH3 sensors

(2019) Jing Zhang et al.   JOURNAL OF APPLIED PHYSICS

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

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

Volatile organic compounds sensing by Li/Ti doped ethylene complex

(2019) Nilesh Ingale et al.   ADSORPTION-JOURNAL OF THE INTERNATIONAL ADSORPTION SOCIETY

Boron-Decorated Graphitic Carbon Nitride (g-C3N4): An Efficient Sensor for H2S, SO2, and NH3 Capture

(2019) Omar Faye et al.   Journal of Physical Chemistry C

Adsorption of O3, SO3 and CH2O on two dimensional SnS monolayer: A first principles study

(2019) Aarti Shukla et al.   PHYSICA B-CONDENSED MATTER

CO2 electrochemical catalytic reduction with a highly active cobalt phthalocyanine

(2019) Min Wang et al.   Nature Communications

Adsorption of NH3 onto vacancy-defected Ti2CO2 monolayer by first-principles calculations

(2019) Li Xiao-Hong et al.   APPLIED SURFACE SCIENCE

First principle study of feasibility of dinitrogen reduction to ammonia on two-dimensional transition metal phthalocyanine monolayer

(2019) Shiqiang Liu et al.   APPLIED SURFACE SCIENCE

Adsorption mechanisms of different volatile organic compounds onto pristine C 2 N and Al-doped C 2 N monolayer: A DFT investigation

(2018) Yuetan Su et al.   APPLIED SURFACE SCIENCE

Gas sensing properties of two-dimensional penta-BP 5 : A first-principle study

(2018) Chuang Feng et al.   CHEMICAL PHYSICS LETTERS

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

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

Theoretical study on the interaction of CO2 and H2O molecules with metal doped-fluorinated phthalocyanines

(2018) Agnes Lincy Arokiyanathan et al.   NEW JOURNAL OF CHEMISTRY

Adsorption of gas molecules on a manganese phthalocyanine molecular device and its possibility as a gas sensor

(2018) Dongqing Zou et al.   PHYSICAL CHEMISTRY CHEMICAL 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

Efficient Selective Electroreduction of CO2 by Single Atom Catalyst TM-Pc Monolayers

(2018) Jinhang Liu et al.   ACS Sustainable Chemistry & Engineering

Prediction of Ti3C2O2 MXene as an effective capturer of formaldehyde

(2018) Yujuan Zhang et al.   APPLIED SURFACE SCIENCE

A MnN4 moiety embedded graphene as a magnetic gas sensor for CO detection: A first principle study

(2018) Sarawoot Impeng 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

Reversible adsorption/desorption of the formaldehyde molecule on transition metal doped graphene by controlling the external electric field: first-principles study

(2017) Tong Zhang et al.   THEORETICAL CHEMISTRY ACCOUNTS

Diamine-appended metal–organic frameworks: enhanced formaldehyde-vapor adsorption capacity, superior recyclability and water resistibility

(2016) Zhong Wang et al.   DALTON TRANSACTIONS

Giant magnetic anisotropy of a 5d transition metal decorated two-dimensional polyphthalocyanine framework

(2016) Peng Wang et al.   Journal of Materials Chemistry C

Monolayer Ti2CO2: A Promising Candidate for NH3 Sensor or Capturer with High Sensitivity and Selectivity

(2015) Xue-fang Yu et al.   ACS Applied Materials & Interfaces

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

Formaldehyde molecule adsorbed on doped graphene: A first-principles study

(2014) Xu-Ying Liu et al.   APPLIED SURFACE SCIENCE

Spin Tuning of Electron-Doped Metal–Phthalocyanine Layers

(2014) Sebastian Stepanow et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The superior catalytic CO oxidation capacity of a Cr-phthalocyanine porous sheet

(2014) Yawei Li et al.   Scientific Reports

Formaldehyde in the Ambient Atmosphere: From an Indoor Pollutant to an Outdoor Pollutant?

(2013) Tunga Salthammer   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Sensing behavior of Al and Si doped BC3 graphenes to formaldehyde

(2013) Javad Beheshtian et al.   SENSORS AND ACTUATORS B-CHEMICAL

Formaldehyde adsorption on pristine, Al-doped and mono-vacancy defected boron nitride nanosheets: A first principles study

(2012) Siamak Noorizadeh et al.   COMPUTATIONAL MATERIALS SCIENCE

Pre-combustion CO2 capture by transition metal ions embedded in phthalocyanine sheets

(2012) Kun Lü et al.   JOURNAL OF CHEMICAL PHYSICS

Detection of phosgene by Sc-doped BN nanotubes: A DFT study

(2012) Javad Beheshtian et al.   SENSORS AND ACTUATORS B-CHEMICAL

Generalized molecular orbital tomography

(2011) C. Vozzi et al.   Nature Physics

Formaldehyde in the Indoor Environment

(2010) Tunga Salthammer et al.   CHEMICAL REVIEWS

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