Chemical applications carried out by local pair natural orbital based coupled-cluster methods

M Sparta, F Neese - Chemical Society Reviews, 2014 - pubs.rsc.org
The scope of this review is to provide a brief overview of the chemical applications carried
out by local pair natural orbital coupled-electron pair and coupled-cluster methods …

[HTML][HTML] Venice's macroalgae-derived active material for aqueous, organic, and solid-state supercapacitors

A Bagheri, S Taghavi, S Bellani, P Salimi… - Chemical Engineering …, 2024 - Elsevier
In this study, self-doped porous activated biochar derived from Venice lagoon's Sargassum
brown macroalgae (ABS) has been successfully prepared through thermochemical …

Molecular simulation study of penetrant gas transport properties into the pure and nanosized silica particles filled polysulfone membranes

K Golzar, S Amjad-Iranagh, M Amani… - Journal of membrane …, 2014 - Elsevier
The simulation techniques have been utilized to investigate the structural, physical and
separation properties of penetrant gases including oxygen, nitrogen, carbon dioxide and …

New cation-exchange membranes based on cross-linked sulfonated polystyrene and polyethylene for power generation systems

EY Safronova, DV Golubenko, NV Shevlyakova… - Journal of Membrane …, 2016 - Elsevier
The present paper is devoted to the properties of sulfonated cation-exchange membranes
obtained by radiation chemical grafting polymerization of styrene with divinylbenzene on a …

Permselectivity and ion-conductivity of grafted cation-exchange membranes based on UV-oxidized polymethylpenten and sulfonated polystyrene

DV Golubenko, G Pourcelly, AB Yaroslavtsev - Separation and purification …, 2018 - Elsevier
In the present study the properties of novel cation-exchange membranes based on UV-
oxidized polymethylpentene (PMP) with grafted sulfonated polystyrene are described. A …

An approach to increase the permselectivity and mono-valent ion selectivity of cation-exchange membranes by introduction of amorphous zirconium phosphate …

DV Golubenko, YA Karavanova, SS Melnikov… - Journal of membrane …, 2018 - Elsevier
This paper addresses hybrid ion exchange membranes fabricated by the synthesis of
amorphous zirconium phosphate (dopant contents from 0.5 to 24 wt%) directly in the pore …

A new lateral method for characterizing the electrical conductivity of ion-exchange membranes

Y Sedkaoui, A Szymczyk, H Lounici, O Arous - Journal of Membrane …, 2016 - Elsevier
A new method for determining the electrical conductivity of ion-exchange membranes was
implemented with four commercial membranes (AMX, CMX, MK-40 and MA-41). It is based …

Conductivity of Nafion-117 membranes intercalated by polar aprotonic solvents

DY Voropaeva, SA Novikova, TL Kulova… - Ionics, 2018 - Springer
The Nafion-117 membranes in the Li+ form with pore-intercalated aprotonic organic solvents
were prepared. The prepared materials were characterized by IR, impedance, and 7 Li NMR …

Water desalination by neutralization dialysis with ion-exchange membranes: Flow rate and acid/alkali concentration effects

M Cherif, I Mkacher, L Dammak, AB Salah, K Walha… - Desalination, 2015 - Elsevier
Kinetics of surface water desalination by neutralization dialysis (ND) was studied in a three-
compartment stack with ion-exchange membranes, and the process feasibility was …

The solvation and ion condensation properties for sulfonated polyelectrolytes in different solvents—a computational study

J Smiatek, A Wohlfarth, C Holm - New Journal of Physics, 2014 - iopscience.iop.org
In contrast to the broad knowledge about aqueous polyelectrolyte solutions, less is known
about the properties in aprotic and apolar solvents. We therefore investigate the behavior of …