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Assessing the impact of valence asymmetry in ionic solutions and its consequences on the performance of supercapacitors

Physical chemistry chemical physics : PCCP, 2022-08, Vol.24 (34), p.2445-2453

2022

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Electric double layer formation and storing energy processes on graphene-based supercapacitors from electrical and thermodynamic perspectives

Journal of molecular modeling, 2020-05, Vol.26 (6), p.159-159, Article 159

Fileti, Eudes Eterno

2020

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Unraveling local structures of Salt-in-Water and Water-in-Salt electrolytes via ab initio molecular dynamics

Journal of molecular liquids, 2023-08, Vol.383 (C), p.122097, Article 122097

2023

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Computational Study of the Properties of Acetonitrile/Water-in-Salt Hybrid Electrolytes as Electrolytes for Supercapacitors

The journal of physical chemistry. B, 2020-07, Vol.124 (27), p.5685-5695

2020

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Elucidating the amphiphilic character of graphene oxide

Physical chemistry chemical physics : PCCP, 2018, Vol.2 (14), p.957-9515

2018

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Investigating the asymmetry in the EDL response of C60/graphene supercapacitors

Physical chemistry chemical physics : PCCP, 2019, Vol.21 (28), p.15362-15371

2019

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Impact of Edge Groups on the Hydration and Aggregation Properties of Graphene Oxide

The journal of physical chemistry. B, 2018-03, Vol.122 (9), p.2578-2586

2018

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Ab initio molecular dynamics study of hydroxyl positioning in butanediol and its impact on deep eutectic solvent structure

Journal of molecular liquids, 2024-09, Vol.409, p.125548, Article 125548

2024

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Salt-in-water and water-in-salt electrolytes: the effects of the asymmetry in cation and anion valence on their properties

Physical chemistry chemical physics : PCCP, 2021-12, Vol.24 (1), p.336-346

2021

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Solvent Polarity Considerations Are Unable to Describe Fullerene Solvation Behavior

The journal of physical chemistry. B, 2014-03, Vol.118 (12), p.3378-3384

2014

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Exploring doped or vacancy-modified graphene-based electrodes for applications in asymmetric supercapacitors

Physical chemistry chemical physics : PCCP, 2020-02, Vol.22 (7), p.396-3913

2020

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Combined Density Functional Theory and Molecular Dynamics Simulations To Investigate the Effects of Quantum and Double-Layer Capacitances in Functionalized Graphene as the Electrode Material of Aqueous-Based Supercapacitors

Journal of physical chemistry. C, 2021-03, Vol.125 (10), p.5518-5524

2021

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An evaluation of the capacitive behavior of supercapacitors as a function of the radius of cations using simulations with a constant potential method

Physical chemistry chemical physics : PCCP, 2022-02, Vol.24 (5), p.328-3288

2022

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Assessing the interaction between surfactant-like peptides and lipid membranes

RSC advances, 2017, Vol.7 (57), p.35973-35981

2017

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Hydration peculiarities of graphene oxides with multiple oxidation degrees

Physical chemistry chemical physics : PCCP, 2017, Vol.19 (48), p.32333-32340

2017

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Note on the Free Energy of Transfer of Fullerene C60 Simulated by Using Classical Potentials

The journal of physical chemistry. B, 2009-05, Vol.113 (20), p.7045-7048

2009

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Prediction of the Hydration Properties of Diamondoids from Free Energy and Potential of Mean Force Calculations

The journal of physical chemistry. B, 2012-11, Vol.116 (45), p.13467-13471

2012

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Graphene/ionic liquid ultracapacitors: does ionic size correlate with energy storage performance?

New journal of chemistry, 2018, Vol.42 (22), p.18409-18417

2018

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GIAO-DFT-NMR characterization of fullerene-cucurbituril complex: the effects of the C60@CB[9] host-guest mutual interactions

Journal of molecular modeling, 2018-07, Vol.24 (7), p.1-9, Article 181

2018

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Theoretical analysis of the hydration of C₆₀ in normal and supercritical conditions

Carbon (New York), 2011, Vol.49 (1), p.187-192

2011

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Storing Energy in Biodegradable Electrochemical Supercapacitors

ACS omega, 2018-10, Vol.3 (10), p.13869-13875

2018

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Strong electronic polarization of the C60 fullerene by imidazolium-based ionic liquids: accurate insights from Born-Oppenheimer molecular dynamic simulations

Physical chemistry chemical physics : PCCP, 2015-06, Vol.17 (24), p.15739-15745

2015

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Molecular Dynamics Study of Surfactant-Like Peptide Based Nanostructures

The journal of physical chemistry. B, 2014-10, Vol.118 (42), p.12215-12222

2014

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Self‐Assembled Peptide–Polyfluorene Nanocomposites for Biodegradable Organic Electronics

Advanced materials interfaces, 2015-09, Vol.2 (14), p.np-n/a

2015

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Free energy of solvation of carbon nanotubes in pyridinium-based ionic liquids

Physical chemistry chemical physics : PCCP, 2016, Vol.18 (3), p.2357-2362

2016

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Assessing the impact of valence asymmetry in ionic solutions and its consequences on the performance of supercapacitors

Electric double layer formation and storing energy processes on graphene-based supercapacitors from electrical and thermodynamic perspectives

Unraveling local structures of Salt-in-Water and Water-in-Salt electrolytes via ab initio molecular dynamics

Computational Study of the Properties of Acetonitrile/Water-in-Salt Hybrid Electrolytes as Electrolytes for Supercapacitors

Elucidating the amphiphilic character of graphene oxide

Investigating the asymmetry in the EDL response of C60/graphene supercapacitors

Impact of Edge Groups on the Hydration and Aggregation Properties of Graphene Oxide

Ab initio molecular dynamics study of hydroxyl positioning in butanediol and its impact on deep eutectic solvent structure

Salt-in-water and water-in-salt electrolytes: the effects of the asymmetry in cation and anion valence on their properties

Solvent Polarity Considerations Are Unable to Describe Fullerene Solvation Behavior

Exploring doped or vacancy-modified graphene-based electrodes for applications in asymmetric supercapacitors

Combined Density Functional Theory and Molecular Dynamics Simulations To Investigate the Effects of Quantum and Double-Layer Capacitances in Functionalized Graphene as the Electrode Material of Aqueous-Based Supercapacitors

An evaluation of the capacitive behavior of supercapacitors as a function of the radius of cations using simulations with a constant potential method

Assessing the interaction between surfactant-like peptides and lipid membranes

Hydration peculiarities of graphene oxides with multiple oxidation degrees

Note on the Free Energy of Transfer of Fullerene C60 Simulated by Using Classical Potentials

Prediction of the Hydration Properties of Diamondoids from Free Energy and Potential of Mean Force Calculations

Graphene/ionic liquid ultracapacitors: does ionic size correlate with energy storage performance?

GIAO-DFT-NMR characterization of fullerene-cucurbituril complex: the effects of the C60@CB[9] host-guest mutual interactions

Theoretical analysis of the hydration of C₆₀ in normal and supercritical conditions

Storing Energy in Biodegradable Electrochemical Supercapacitors

Strong electronic polarization of the C60 fullerene by imidazolium-based ionic liquids: accurate insights from Born-Oppenheimer molecular dynamic simulations

Molecular Dynamics Study of Surfactant-Like Peptide Based Nanostructures

Self‐Assembled Peptide–Polyfluorene Nanocomposites for Biodegradable Organic Electronics

Free energy of solvation of carbon nanotubes in pyridinium-based ionic liquids

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