:: Library Catalog

Cover Image

Saved in:

Bibliographic Details
Main Authors:	Vekeman, Jelle, Vandenabeele, Dries, Doppelhammer, Nikolaus, Vandeurzen, Elisabeth, Breynaert, Eric, Kirschhock, Christine E. A., Verstraelen, Toon
Format:	Preprint
Published:	2024
Subjects:	Chemical Physics
Online Access:	https://arxiv.org/abs/2404.14170
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Hydrated Silicate Ionic Liquids: Ionic Liquids for Silicate Material Synthesis
by: Vandenabeele, Dries, et al.
Published: (2024)

Can the combination of in situ differential impedance spectroscopy and 27Al NMR detect incongruent zeolite crystallization?
by: Vandenabeele, Dries, et al.
Published: (2024)

Competitive Adsorption of Toluene and Water in MFI-type Zeolites
by: Arbiv, Gavriel, et al.
Published: (2025)

STable AutoCorrelation Integral Estimator (STACIE): Robust and accurate transport properties from molecular dynamics simulations
by: Toraman, Gözdenur, et al.
Published: (2025)

NMR crystallography reveals carbonate induced Al-ordering in ZnAl layered double hydroxide
by: Radhakrishnan, Sambhu, et al.
Published: (2021)

Managing Expectations and Imbalanced Training Data in Reactive Force Field Development: an Application to Water Adsorption on Alumina
by: Dumortier, Loïc, et al.
Published: (2024)

Ionic Liquid Molecular Dynamics Simulation with Machine Learning Force Fields: DPMD and MACE
by: Park, Anseong, et al.
Published: (2025)

The Photochemical Birth of the Hydrated Electron in Liquid Water
by: Mirón, Gonzalo Díaz, et al.
Published: (2025)

Interactive framework for techno-economic meta-analysis of marine hydrogen transportation
by: Hanssens, Lucas, et al.
Published: (2025)

Enhanced Ionic Conductivity of confined Ionic-Liquid in Angstrom-scale 2D channels
by: Yang, Jing, et al.
Published: (2026)

Solution-corrected Constant Potential Model for CO2 Electrocatalysis in Ionic Liquids
by: Sun, Jikai, et al.
Published: (2025)

Protic Ionic Liquids in Contrast to Aprotic Analogs: Transport Properties and Electrochemical Reactivity
by: Masayoshi Watanabe, et al.
Published: (2026)

Enhanced Deep Potential Model for Fast and Accurate Molecular Dynamics; Application to the Hydrated Electron
by: Gao, Ruiqi, et al.
Published: (2024)

Is the Electron Hydrated Through Covalent Sharing?
by: Sajeev, Y.
Published: (2025)

Energy‐Efficient Styrene Production by Incorporating Ionic Liquid‐Based Separation Technology
by: Yang Lei, et al.
Published: (2025)

Thermal Conductivity of Metastable Ionic Liquid [$C_{2}mim$][$CH_{3}SO_{3}$]
by: Lozano-Martín, Daniel, et al.
Published: (2024)

Reliable Viscosity Calculation from High-Pressure Equilibrium Molecular Dynamics: Case Study of 2,2,4-Trimethylhexane
by: Toraman, Gözdenur, et al.
Published: (2026)

Electric Field Induced Associations in the Double Layer of Salt-in-Ionic-Liquid Electrolytes
by: Markiewitz, Daniel M., et al.
Published: (2024)

Transferability and Accuracy of Ionic Liquid Simulations with Equivariant Machine Learning Interatomic Potentials
by: Goodwin, Zachary A. H., et al.
Published: (2024)

Recent Advances in the Utilization of Imidazolium‐Based Ionic Liquids for Chemical‐Enhanced Oil Recovery: A Comprehensive Review
by: Noran Mousa, et al.
Published: (2025)

Graph Neural Networks for Temperature-Dependent Activity Coefficient Prediction of Solutes in Ionic Liquids
by: Rittig, Jan G., et al.
Published: (2022)

Bridging Electrostatic Screening and Ion Transport in Lithium Salt-Doped Ionic Liquids
by: Park, Hyungshick, et al.
Published: (2025)

Polymeric Ionic Liquid: An Efficient Homogeneous Catalyst for Production of 5‐HMF in a Plug Flow Reactor
by: Ayush Vasishta, et al.
Published: (2026)

Influence of Pore Size on Cycloaddition Reaction of CO2 and Epoxide Catalyzed by Supported Imidazolium Ionic Liquids
by: Xiaohan Yu, et al.
Published: (2024)

Liquid–Liquid Equilibrium with Ab Initio Molecular Dynamics Simulation and NRTL Parameter Estimation
by: Su Yeong Jeong, et al.
Published: (2024)

Ultrafast Relaxation Dynamics of Inner-Shell Vacancies in Hydrated Pyrrole
by: Wang, Kedong, et al.
Published: (2025)

Chirality-Induced Magnetization of Magnetite by an RNA Precursor
by: Ozturk, S. Furkan, et al.
Published: (2023)

Impact of Electron-Withdrawing Groups on Ion Transport and Structure in Lithium Borate Ionic Liquids
by: Koverga, Volodymyr, et al.
Published: (2023)

Chronoamperometry with Room-Temperature Ionic Liquids: Sub-Second Inference Techniques
by: France, Kordel K.
Published: (2025)

Machine-Learned Electrostatic Potentials for Accurate Hydration Free Energy Calculations
by: Hilfiker, Mathias, et al.
Published: (2025)

Simple Hückel Molecular Orbital Theory for Möbius Carbon Nanobelts
by: Wang, Yang
Published: (2024)

An Accurate Tensorial Model for Prediction of Full Zeolite NMR Spectra
by: Bornes, Carlos, et al.
Published: (2026)

Resolving Discrepancies in Disjoining Pressure Predictions for Liquid Nanofilms from Molecular Simulations
by: Yang, Yafan, et al.
Published: (2026)

Recent Advances in Metal‐Based Catalysts for Nitrile Hydration to Amides: Mechanistic Aspects
by: Fatima‐Ezzahraa Essebbar, et al.
Published: (2025)

AI-Guided Discovery of Novel Ionic Liquid Solvents for Industrial CO2 Capture
by: Garbelotto, Davide, et al.
Published: (2026)

Alkylation of Phenol with Methanol over ZSM‐5 Zeolite
by: Naiwang Liu, et al.
Published: (2024)

Re-Dock: Towards Flexible and Realistic Molecular Docking with Diffusion Bridge
by: Huang, Yufei, et al.
Published: (2024)

Self‐assembly of Tyrosine Scaffolds in Aqueous Media: Complex Molecular Architectures from Simple Building Blocks
by: Dineshkumar Bharathidasan, et al.
Published: (2025)

Molecular-Resolution Imaging of Ice Crystallized from Liquid Water
by: Du, Jingshan S., et al.
Published: (2024)

Desulfurization of Gasoline and Diesel by Fly Ash‐Derived FAU Zeolite
by: Januario Da Costa Hossi, et al.
Published: (2024)