Lista de obras -

A Mechanistic and Kinetic Study on the Decomposition of Morpholine ⬇️

artículo científico publicado el 11 de julio de 2012

A first-principles density functional study of chlorophenol adsorption on Cu2O(110):CuO.

artículo científico publicado en 2009

A mechanistic and kinetic study on the formation of PBDD/Fs from PBDEs.

artículo científico publicado en 2013

An Insight into Geometries and Catalytic Applications of CeO2 from a DFT Outlook

artículo científico publicado en 2021

Catalytic Hydrogenation of p-Chloronitrobenzene to p-Chloroaniline Mediated by γ-Mo2N

artículo científico publicado en 2018

Development of Organo-Dispersible Graphene Oxide via Pseudo-Surface Modification for Thermally Conductive Green Polymer Composites

scientific article published on 24 December 2018

Electrodeposition of Polypyrrole and Reduced Graphene Oxide onto Carbon Bundle Fibre as Electrode for Supercapacitor

artículo científico publicado en 2017

Formation and chlorination of carbazole, phenoxazine, and phenazine

artículo científico publicado en 2015

Formation of Environmentally-Persistent Free Radicals (EPFR) on α-Al2O3.

artículo científico publicado en 2016

Formation of PCDD/Fs in Oxidation of 2-Chlorophenol on Neat Silica Surface

artículo científico publicado en 2015

Formation of dibenzofuran, dibenzo-p-dioxin and their hydroxylated derivatives from catechol

artículo científico publicado en 2014

Formation of mixed halogenated dibenzo-p-dioxins and dibenzofurans (PXDD/Fs).

artículo científico publicado en 2015

Formation of polybrominated dibenzofurans from polybrominated biphenyls

scientific article published on 08 October 2014

Hydration and Secondary Ozonide of the Criegee Intermediate of Sabinene

artículo científico publicado en 2018

Hydrogen Abstraction from Hydrocarbons by NH2.

artículo científico publicado en 2017

Inhibition and Promotion of Pyrolysis by Hydrogen Sulfide (H2S) and Sulfanyl Radical (SH).

artículo científico publicado en 2016

Kinetics of Photo-Oxidation of Oxazole and its Substituents by Singlet Oxygen

scientific article published on 28 February 2020

Mechanism of thermal decomposition of tetrabromobisphenol A (TBBA).

artículo científico publicado en 2014

Mechanisms of transformation of polychlorinated diphenyl ethers into polychlorinated dibenzo-p-dioxins and dibenzofurans.

artículo científico publicado en 2014

New Mechanistic Insights: Why Do Plants Produce Isoprene?

article

Photodecomposition of bromophenols.

artículo científico publicado en 2015

Quantum chemical study on formation of PCDT/TA from 2-chlorothiophenol precursor

artículo científico publicado en 2013

Rate constants for hydrogen abstraction reactions by the hydroperoxyl radical from methanol, ethenol, acetaldehyde, toluene, and phenol

artículo científico publicado en 2011

Reaction of Aniline with Singlet Oxygen (O21Δg).

artículo científico publicado en 2017

Reaction of phenol with singlet oxygen

scientific article published on 01 December 2018

Recycling of zincite (ZnO) via uptake of hydrogen halides

artículo científico publicado en 2017

Review of Chemical Reactivity of Singlet Oxygen with Organic Fuels and Contaminants

artículo científico publicado en 2020

S-Nitrosation of Aminothiones.

artículo científico publicado en 2015

Structures, electronic properties and stability phase diagrams for copper(I/II) bromide surfaces.

artículo científico publicado en 2015

Study of structural properties and defects of Ni-doped SnO2 nanorods as ethanol gas sensors

artículo científico publicado en 2017

The structures and thermodynamic stability of copper(II) chloride surfaces.

artículo científico publicado en 2014

Theoretical insight into chlorine adsorption on the Fe(100) surface.

artículo científico publicado en 2014

Theoretical study of the ammonia-hypochlorous acid reaction mechanism

artículo científico publicado en 2010

Theoretical study of unimolecular decomposition of catechol.

artículo científico publicado en 2010

Theoretical study on the thermodynamic properties and self-decomposition of methylbenzenediol isomers.

artículo científico publicado en 2010

Theoretical study on the unimolecular decomposition of thiophenol

artículo científico publicado en 2011

Thermal Recycling of Brominated Flame Retardants with Fe2O3.

artículo científico publicado en 2016

Thermal Reduction of NOx with Recycled Plastics.

artículo científico publicado en 2017

Thermal decomposition of 1,2-bis(2,4,6-tribromophenoxy)ethane (BTBPE), a novel brominated flame retardant

artículo científico publicado en 2014

Thermochemical properties and decomposition pathways of three isomeric semiquinone radicals.

artículo científico publicado en 2010

Thermodynamic stability and structures of iron chloride surfaces: a first-principles investigation.

artículo científico publicado en 2014

Understanding the adsorptive interactions of arsenate-iron nanoparticles with curved fullerene-like sheets in activated carbon using a quantum mechanics/molecular mechanics computational approach

artículo científico publicado en 2017

Unimolecular Decomposition Reactions of Propylamine and Protonated Propylamine

scientific article published on 14 February 2019

Lista de obras de

A Mechanistic and Kinetic Study on the Decomposition of Morpholine ⬇️

A first-principles density functional study of chlorophenol adsorption on Cu2O(110):CuO.

A mechanistic and kinetic study on the formation of PBDD/Fs from PBDEs.

An Insight into Geometries and Catalytic Applications of CeO2 from a DFT Outlook

Catalytic Hydrogenation of p-Chloronitrobenzene to p-Chloroaniline Mediated by γ-Mo2N

Development of Organo-Dispersible Graphene Oxide via Pseudo-Surface Modification for Thermally Conductive Green Polymer Composites

Electrodeposition of Polypyrrole and Reduced Graphene Oxide onto Carbon Bundle Fibre as Electrode for Supercapacitor

Formation and chlorination of carbazole, phenoxazine, and phenazine

Formation of Environmentally-Persistent Free Radicals (EPFR) on α-Al2O3.

Formation of PCDD/Fs in Oxidation of 2-Chlorophenol on Neat Silica Surface

Formation of dibenzofuran, dibenzo-p-dioxin and their hydroxylated derivatives from catechol

Formation of mixed halogenated dibenzo-p-dioxins and dibenzofurans (PXDD/Fs).

Formation of polybrominated dibenzofurans from polybrominated biphenyls

Hydration and Secondary Ozonide of the Criegee Intermediate of Sabinene

Hydrogen Abstraction from Hydrocarbons by NH2.

Inhibition and Promotion of Pyrolysis by Hydrogen Sulfide (H2S) and Sulfanyl Radical (SH).

Kinetics of Photo-Oxidation of Oxazole and its Substituents by Singlet Oxygen

Mechanism of thermal decomposition of tetrabromobisphenol A (TBBA).

Mechanisms of transformation of polychlorinated diphenyl ethers into polychlorinated dibenzo-p-dioxins and dibenzofurans.

New Mechanistic Insights: Why Do Plants Produce Isoprene?

Photodecomposition of bromophenols.

Quantum chemical study on formation of PCDT/TA from 2-chlorothiophenol precursor

Rate constants for hydrogen abstraction reactions by the hydroperoxyl radical from methanol, ethenol, acetaldehyde, toluene, and phenol

Reaction of Aniline with Singlet Oxygen (O21Δg).

Reaction of phenol with singlet oxygen

Recycling of zincite (ZnO) via uptake of hydrogen halides

Review of Chemical Reactivity of Singlet Oxygen with Organic Fuels and Contaminants

S-Nitrosation of Aminothiones.

Structures, electronic properties and stability phase diagrams for copper(I/II) bromide surfaces.

Study of structural properties and defects of Ni-doped SnO2 nanorods as ethanol gas sensors

The structures and thermodynamic stability of copper(II) chloride surfaces.

Theoretical insight into chlorine adsorption on the Fe(100) surface.

Theoretical study of the ammonia-hypochlorous acid reaction mechanism

Theoretical study of unimolecular decomposition of catechol.

Theoretical study on the thermodynamic properties and self-decomposition of methylbenzenediol isomers.

Theoretical study on the unimolecular decomposition of thiophenol

Thermal Recycling of Brominated Flame Retardants with Fe2O3.

Thermal Reduction of NOx with Recycled Plastics.

Thermal decomposition of 1,2-bis(2,4,6-tribromophenoxy)ethane (BTBPE), a novel brominated flame retardant

Thermochemical properties and decomposition pathways of three isomeric semiquinone radicals.

Thermodynamic stability and structures of iron chloride surfaces: a first-principles investigation.

Understanding the adsorptive interactions of arsenate-iron nanoparticles with curved fullerene-like sheets in activated carbon using a quantum mechanics/molecular mechanics computational approach

Unimolecular Decomposition Reactions of Propylamine and Protonated Propylamine