Performance of curing epoxy resin as potential anticorrosive coating for carbon steel in 3.5% NaCl medium: Combining experimental and computational approaches

Polymer composite materials : A comprehensive review

(2021) Rachid Hsissou et al.   COMPOSITE STRUCTURES

Influence of silanized bacterial cellulose on the mode I interlaminar fracture toughness of glass fiber filled with epoxy resin

(2021) Cuong Manh Vu et al.   COMPOSITE INTERFACES

Insight into the corrosion inhibition of novel macromolecular epoxy resin as highly efficient inhibitor for carbon steel in acidic mediums: Synthesis, characterization, electrochemical techniques, AFM/UV-Visible and computational investigations

(2021) R. Hsissou et al.   JOURNAL OF MOLECULAR LIQUIDS

The composite microbeads of alginate, carrageenan, gelatin, and poly(lactic-co-glycolic acid): Synthesis, characterization and Density Functional Theory calculations

(2021) Demet Baybaş et al.   INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES

Review on epoxy polymers and its composites as a potential anticorrosive coatings for carbon steel in 3.5% NaCl solution: Computational approaches

(2021) Rachid Hsissou   JOURNAL OF MOLECULAR LIQUIDS

Performance of two new epoxy resins as potential corrosion inhibitors for carbon steel in 1MHCl medium: Combining experimental and computational approaches

(2021) Naoual El-Aouni et al.   COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS

Trifunctional epoxy polymer as corrosion inhibition material for carbon steel in 1.0 M HCl: MD simulations, DFT and complexation computations

(2020) Rachid Hsissou et al.   INORGANIC CHEMISTRY COMMUNICATIONS

Phosphorous-jointed epoxidized soybean oil and rice husk-based silica as the novel additives for improvement mechanical and flame retardant of epoxy resin

(2020) Cuong Manh Vu et al.   JOURNAL OF FIRE SCIENCES

Evaluation of Mechanical compressive strength of cementitious matrix with 12% of IER formulated by modified polymer (NEPS) at different percentages

(2020) Atiqa Bekhta et al.   Scientific Reports

Evaluation of corrosion inhibition performance of phosphorus polymer for carbon steel in [1 M] HCl: Computational studies (DFT, MC and MD simulations)

(2020) Rachid Hsissou et al.   Journal of Materials Research and Technology-JMR&T

Combined electronic/atomic level computational, surface (SEM/EDS), chemical and electrochemical studies of the mild steel surface by quinoxalines derivatives anti-corrosion properties in 1 mol⋅L-1 HCl solution

(2020) F. Benhiba et al.   CHINESE JOURNAL OF CHEMICAL ENGINEERING

Nitro substituent effect on the electronic behavior and inhibitory performance of two quinoxaline derivatives in relation to the corrosion of mild steel in 1 M HCl

(2020) F. Benhiba et al.   JOURNAL OF MOLECULAR LIQUIDS

Effects of DOPO-Grafted Epoxidized Soybean Oil on Fracture Toughness and Flame Retardant of Epoxy Resin/Rice Husk Silica Hybrid

(2020) Cuong Manh Vu et al.   MACROMOLECULAR RESEARCH

Oxidized multiwall carbon nanotubes filled epoxy-based coating: fabrication, anticorrosive, and mechanical characteristics

(2020) Cuong Manh Vu et al.   POLYMER BULLETIN

Development and potential performance of prepolymer in corrosion inhibition for carbon steel in 1.0 M HCl: Outlooks from experimental and computational investigations

(2020) Rachid Hsissou et al.   JOURNAL OF COLLOID AND INTERFACE SCIENCE

Sample synthesis, characterization, experimental and theoretical study of the inhibitory power of new 8-hydroxyquinoline derivatives for mild steel in 1.0 M HCl

(2020) M. Rbaa et al.   JOURNAL OF MOLECULAR STRUCTURE

Mixed Ligand Copper(II) Chelates derived from an O, N, S- Donor Tridentate Thiosemicarbazone: Synthesis, Spectral Aspects, FMO, and NBO Analysis

(2020) Jinsa Mary Jacob et al.   POLYHEDRON

MWCNT grafted with POSS-based novel flame retardant-filled epoxy resin nanocomposite: fabrication, mechanical properties, and flammability

(2020) Van-Huy Nguyen et al.   COMPOSITE INTERFACES

Epoxy resins and their zinc composites as novel anti-corrosive materials for copper in 3% sodium chloride solution: Experimental and computational studies

(2020) O. Dagdag et al.   JOURNAL OF MOLECULAR LIQUIDS

Effect of the Aromatic Amine Curing Agent Structure on Properties of Epoxy Resin-Based Syntactic Foams

(2020) Sizhu Yu et al.   ACS Omega

Eco-friendly sodium gluconate and trisodium citrate inhibitors for low carbon steel in simulated cooling water system: Theoretical study and molecular dynamic simulations

(2020) Goncagül Serdaroğlu et al.   JOURNAL OF MOLECULAR LIQUIDS

Why and When Is Electrophilicity Minimized? New Theorems and Guiding Rules

(2020) László von Szentpály et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Synthesis and anticorrosive properties of epoxy polymer for CS in [1 M] HCl solution: Electrochemical, AFM, DFT and MD simulations

(2020) Rachid Hsissou et al.   CONSTRUCTION AND BUILDING MATERIALS

Preparation of diamine-based polybenzoxazine coating for corrosion protection on mild steel

(2019) Rui Zhang et al.   JOURNAL OF POLYMER RESEARCH

Enhancing mode I and II interlaminar fracture toughness of carbon fiber-filled epoxy-based composites using both rice husk silica and silk fibroin electrospun nanofibers

(2019) Quang-Vu Bach et al.   HIGH PERFORMANCE POLYMERS

Molecular Assembly between Weak Crosslinking Cyclodextrin Polymer and trans-Cinnamaldehyde for Corrosion Inhibition towards Mild Steel in 3.5% NaCl Solution: Experimental and Theoretical Studies

(2019) Yucong Ma et al.   Polymers

Novel derivative epoxy resin TGETET as a corrosion inhibition of E24 carbon steel in 1.0 M HCl solution. Experimental and computational (DFT and MD simulations) methods

(2019) Rachid Hsissou et al.   JOURNAL OF MOLECULAR LIQUIDS

Carbon-Fiber-Reinforced Epoxy Resin with Sustainable Additives from Silk and Rice Husks for Improved Mode-I and Mode-II Interlaminar Fracture Toughness

(2019) Cuong Manh Vu et al.   MACROMOLECULAR RESEARCH

Anticorrosive property of hexafunctional epoxy polymer HGTMDAE for E24 carbon steel corrosion in 1.0 M HCl: gravimetric, electrochemical, surface morphology and molecular dynamic simulations

(2019) Rachid Hsissou et al.   POLYMER BULLETIN

Highly effective mild steel corrosion inhibition in 1 M HCl solution by novel green aqueous Mustard seed extract: Experimental, electronic-scale DFT and atomic-scale MC/MD explorations

(2019) Ghasem Bahlakeh et al.   JOURNAL OF MOLECULAR LIQUIDS

Epoxidized soybean oil grafted with CTBN as a novel toughener for improving the fracture toughness and mechanical properties of epoxy resin

(2019) Quang-Vu Bach et al.   POLYMER JOURNAL

Harmine derivatives: a comprehensive quantum chemical investigation of the structural, electronic (FMO, NBO, and MEP), and spectroscopic (FT-IR and UV–Vis) properties

(2019) Goncagül Serdaroğlu   RESEARCH ON CHEMICAL INTERMEDIATES

Epoxy pre-polymers as new and effective materials for corrosion inhibition of carbon steel in acidic medium: Computational and experimental studies

(2019) Omar Dagdag et al.   Scientific Reports

POSS-tetraaniline modified graphene for active corrosion protection of epoxy-based organic coating

(2019) Yuwei Ye et al.   CHEMICAL ENGINEERING JOURNAL

A molecular dynamics study on heat conduction of crosslinked epoxy resin based thermal interface materials for thermal management

(2019) Xinjian Liu et al.   COMPUTATIONAL MATERIALS SCIENCE

New detailed insights on the role of a novel praseodymium nanofilm on the polymer/steel interfacial adhesion bonds in dry and wet conditions: An integrated molecular dynamics simulation and experimental study

(2018) Ghasem Bahlakeh et al.   Journal of the Taiwan Institute of Chemical Engineers

Improvement of the mode I interlaminar fracture toughness of glass fiber/epoxy composites using polystyrene electrospun nanofibres

(2018) Dinh Duc Nguyen et al.   POLYMER BULLETIN

Synthesis characterization rheological and morphological study of a new epoxy resin pentaglycidyl ether pentaphenoxy of phosphorus and their composite (PGEPPP/MDA/PN)

(2018) Rachid Hsissou et al.   POLYMER BULLETIN

Investigation and comparative study of the quantum molecular descriptors derived from the theoretical modeling and Monte Carlo simulation of two new macromolecular polyepoxide architectures TGEEBA and HGEMDA

(2018) R. Hsissou et al.   JOURNAL OF KING SAUD UNIVERSITY SCIENCE

Thermal expansion and dynamic mechanical analysis of epoxy matrix–borosilicate glass hollow particle syntactic foams

(2017) Steven Eric Zeltmann et al.   JOURNAL OF CELLULAR PLASTICS

Production and characterization of epoxy syntactic foams highly loaded with thermoplastic microballoons

(2017) Kerrick R Dando et al.   JOURNAL OF CELLULAR PLASTICS

Pyranpyrazole derivatives as novel corrosion inhibitors for mild steel useful for industrial pickling process: Experimental and Quantum Chemical study

(2017) Parul Dohare et al.   JOURNAL OF INDUSTRIAL AND ENGINEERING CHEMISTRY

Thirty years of density functional theory in computational chemistry: an overview and extensive assessment of 200 density functionals

(2017) Narbe Mardirossian et al.   MOLECULAR PHYSICS

Study on the synthesis of bio-based epoxy curing agent derived from myrcene and castor oil and the properties of the cured products

(2017) Xuejuan Yang et al.   RSC Advances

Toward understanding the adsorption mechanism of large size organic corrosion inhibitors on an Fe(110) surface using the DFTB method

(2017) Lei Guo et al.   RSC Advances

Corrosion Study of Mild Steel in Aqueous Sulfuric Acid Solution Using 4-Methyl-4H-1,2,4-Triazole-3-Thiol and 2-Mercaptonicotinic Acid—An Experimental and Theoretical Study

(2017) Valbonë V. Mehmeti et al.   Frontiers in Chemistry

Evaluating electronic structure of quinazolinone and pyrimidinone molecules for its corrosion inhibition effectiveness on target specific mild steel in the acidic medium: A combined DFT and MD simulation study

(2016) Sourav Kr. Saha et al.   JOURNAL OF MOLECULAR LIQUIDS

A Close-up of the Effect of Iron Oxide Type on the Interfacial Interaction between Epoxy and Carbon Steel: Combined Molecular Dynamics Simulations and Quantum Mechanics

(2016) Ghasem Bahlakeh et al.   Journal of Physical Chemistry C

Novel DOPO-based epoxy curing agents

(2016) Xiaodong Qian et al.   JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY

Novel Schiff-base molecules as efficient corrosion inhibitors for mild steel surface in 1 M HCl medium: experimental and theoretical approach

(2016) Sourav Kr. Saha et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Effect of the hardener to epoxy monomer ratio on the water absorption behavior of the DGEBA/TETA epoxy system

(2016) Ayrton Alef Castanheira Pereira et al.   Polimeros-Ciencia e Tecnologia

Fracture toughness and surface morphology of micro/nano sized fibrils-modified epoxy resin

(2016) Cuong Manh Vu et al.   POLYMER SCIENCE SERIES A

Ab Initio Calculations on some Antiepileptic Drugs such as Phenytoin, Phenbarbital, Ethosuximide and Carbamazepine

(2016) Goncagül Serdaroğlu et al.   STRUCTURAL CHEMISTRY

Evaluating corrosion inhibition property of some Schiff bases for mild steel in 1 M HCl: competitive effect of the heteroatom and stereochemical conformation of the molecule

(2016) Alokdut Dutta et al.   RSC Advances

Novel Multifunctional Organic–Inorganic Hybrid Curing Agent with High Flame-Retardant Efficiency for Epoxy Resin

(2015) Yi Tan et al.   ACS Applied Materials & Interfaces

Theoretical and experimental studies of the corrosion behavior of some thiazole derivatives toward mild steel in sulfuric acid media

(2015) Avni Berisha et al.   Macedonian Journal of Chemistry and Chemical Engineering

A new method for calculation of molecular hardness: A theoretical study

(2015) Savaş Kaya et al.   Computational and Theoretical Chemistry

Hydroxyethylcellulose used as an eco-friendly inhibitor for 1018 c-steel corrosion in 3.5% NaCl solution

(2014) Mahmoud N. EL-Haddad   CARBOHYDRATE POLYMERS

Effect of Additive-added Epoxy on Mechanical and Dielectric Characteristics of Glass Fiber Reinforced Epoxy Composites

(2014) Cuong Manh Vu et al.   POLYMER-KOREA

Role of Surface Oxide Properties on the Aluminum/Epoxy Interfacial Bonding

(2013) Bekir Salgin et al.   Journal of Physical Chemistry C

In Situ Study of Buried Metal–Polymer Interfaces Exposed to an Aqueous Solution by an Integrated ATR-FTIR and Electrochemical Impedance Spectroscopy System

(2013) P. Taheri et al.   Journal of Physical Chemistry C

Experimental and computational studies of two antibacterial drugs as corrosion inhibitors for mild steel in acid media

(2013) L. Guo et al.   MATERIALS AND CORROSION-WERKSTOFFE UND KORROSION

Thermal Control of Nanostructure and Molecular Network Development in Epoxy-Amine Thermosets

(2012) Christopher M. Sahagun et al.   ACS Applied Materials & Interfaces

Corrosion performance of epoxy coatings containing silane treated ZrO2 nanoparticles on mild steel in 3.5% NaCl solution

(2010) M. Behzadnasab et al.   CORROSION SCIENCE

DFT and Ab initio computational study on the reactivity sites of the GABA and its agonists, such as CACA, TACA, DABA, and muscimol: In the gas phase and dielectric media

(2010) Goncagül Serdaroğlu   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

A DFT study of determination of the reactive sites of the acetylcholine and its agonists: In the gas phase and dielectric medium

(2010) Goncagül Serdaroğlu   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Effect of Conversion on the Structure−Property Relationships of Amine-Cured Epoxy Thermosets

(2009) Maurice J. Marks et al.   ACS Applied Materials & Interfaces

Inhibition effect of 4-phenylthiazole derivatives on corrosion of 304L stainless steel in HCl solution

(2009) A.S. Fouda et al.   CORROSION SCIENCE