Works cited by this work

92 works

Work: Dual-functional Quercus palustris leaves extract as a sustainable corrosion inhibitor for low-carbon steel and its biomedical potential: Electrochemical, biological, and computational insights

LAMMPS - a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales
Aidan P. Thompson, Hasan Metin Aktulga, Richard Berger +12
Article202132 citations
ABI
Basis Set Exchange: A Community Database for Computational Sciences
Karen Schuchardt, Brett Didier, Todd Elsethagen +5
Article200715 citations
ABI
Experimental and computational studies on hydroxamic acids as environmental friendly chelating corrosion inhibitors for mild steel in aqueous acidic medium
Dakeshwar Kumar Verma, Akram Al Fantazi, Chandrabhan Verma +4
Article202013 citations
ABI
Investigations on some coumarin based corrosion inhibitors for mild steel in aqueous acidic medium: Electrochemical, surface morphological, density functional theory and Monte Carlo simulation approach
Dakeshwar Kumar Verma, Savaş Kaya, Elhachmia Ech-chihbi +3
Article202112 citations
ABI
Corrosion inhibition, surface adsorption and computational studies of Swertia chirata extract: A sustainable and green approach
Rajesh Haldhar, Dwarika Prasad, Dang Le Tri Nguyen +4
Article202111 citations
ABI
Inhibition performances of new pyrazole derivatives against the corrosion of C38 steel in acidic medium: Computational study
Savaş Kaya, Farhan Siddique, Dilara Özbakır Işın +3
Article202411 citations
ABI
Anticorrosive properties of a green and sustainable inhibitor from leaves extract of Cannabis sativa plant: Experimental and theoretical approach
Rajesh Haldhar, Dwarika Prasad, Nripendranath Mandal +3
Article202110 citations
ABI
Anti-Corrosion Coating Formation by a Biopolymeric Extract of Artemisia herba-alba Plant: Experimental and Theoretical Investigations
Walid Daoudi, Abdelmalik El Aatiaoui, Omar Dagdag +9
Article202310 citations
ABI
An overview on plant extracts as environmental sustainable and green corrosion inhibitors for metals and alloys in aggressive corrosive media
Chandrabhan Verma, Eno E. Ebenso, Indra Bahadur +1
Article20189 citations
ABI
Use of Sida cordifolia extract as green corrosion inhibitor for mild steel in 0.5 M H2SO4
Akhil Saxena, Dwarika Prasad, Rajesh Haldhar +2
Article20179 citations
ABI
Quantum Chemistry for Solvated Molecules on Graphical Processing Units Using Polarizable Continuum Models
Fang Liu, Nathan Luehr, Heather J. Kulik +1
Article20158 citations
ABI
Development of a ReaxFF Reactive Force Field for Fe/Cr/O/S and Application to Oxidation of Butane over a Pyrite-Covered Cr<sub>2</sub>O<sub>3</sub> Catalyst
Yun Kyung Shin, Hyunwook Kwak, Alex V. Vasenkov +2
Article20158 citations
ABI
A comprehensive electron wavefunction analysis toolbox for chemists, Multiwfn
Tian Lu
Article20248 citations
ABI
Glycyrrhiza glabra leaves extract as a green corrosion inhibitor for mild steel in 1 M hydrochloric acid solution: Experimental, molecular dynamics, Monte Carlo and quantum mechanics study
Eiman Alibakhshi, Mohammad Ramezanzadeh, Ghasem Bahlakeh +3
Article20187 citations
ABI
Myristica fragrans extract as an eco-friendly corrosion inhibitor for mild steel in 0.5 M H2SO4 solution
Rajesh Haldhar, Dwarika Prasad, Akhil Saxena
Article20187 citations
ABI
DL-FIND: An Open-Source Geometry Optimizer for Atomistic Simulations
Johannes Kästner, Joanne M. Carr, Thomas W. Keal +3
Article20097 citations
ABI
Extension of the D3 dispersion coefficient model
Eike Caldeweyher, Christoph Bannwarth, Stefan Grimme
Article20177 citations
ABI
Generating Efficient Quantum Chemistry Codes for Novel Architectures
A.V. Titov, Ivan S. Ufimtsev, Nathan Luehr +1
Article20126 citations
ABI
Inhibition performance of Glycine max, Cuscuta reflexa and Spirogyra extracts for mild steel dissolution in acidic medium: Density functional theory and experimental studies
Dakeshwar Kumar Verma, Fahmida Khan, Indra Bahadur +4
Article20185 citations
ABI
Development of different chain lengths ionic liquids as green corrosion inhibitors for oil and gas industries: Experimental and theoretical investigations
Rajesh Haldhar, Chaitany Jayprakash Raorane, Vivek Kumar Mishra +3
Article20225 citations
ABI
A combined experimental and theoretical study of green corrosion inhibition of mild steel in HCl solution by aqueous Citrullus lanatus fruit (CLF) extract
Ali Dehghani, Ghasem Bahlakeh, Bahram Ramezanzadeh +1
Article20194 citations
ABI
Isopentyltriphenylphosphonium bromideionic liquid as a newly effective corrosion inhibitor on metal-electrolyte interface in acidic medium: Experimental, surface morphological (SEM-EDX & AFM) and computational analysis
Madhusudan Goyal, Hemlata Vashisht, Ajai Kumar +4
Article20204 citations
ABI
Research of Lilium brownii leaves extract as a commendable and green inhibitor for X70 steel corrosion in hydrochloric acid
Xiuli Zuo, Wenpo Li, Wei Luo +5
Article20204 citations
ABI
Evaluation of Lavandula mairei extract as green inhibitor for mild steel corrosion in 1 M HCl solution. Experimental and theoretical approach
A. Berrissoul, Aicha Ouarhach, F. Benhiba +5
Article20204 citations
ABI
Anticorrosion and rheological properties of Calyptocarpus vialis extract as a green coating for mild steel in 2MH2SO4
Vishwajeet Bachhar, Vibha Joshi, Prayas Singh +4
Article20244 citations
ABI