[HTML][HTML] Computing solubility and thermodynamic properties of H2O2 in water

THG Saji, JM Vicent-Luna, TJH Vlugt, S Calero… - Journal of Molecular …, 2024 - Elsevier
Hydrogen peroxide plays a key role in many environmental and industrial chemical
processes. We performed classical Molecular Dynamics and Continuous Fractional …

Solvatochromism as a tool to visually recognise wide range of commonly used solvents and inexpensive dye based optical sensor for H2O, D2O and H2O2

A Kakoti, J Borah, UN Hazarika, SP Bharadwaj… - Journal of Molecular …, 2023 - Elsevier
An inexpensive bisphenol based optical sensor (BP) obtained from single step reaction of 4-
hydroxybenzyladehyde and 2, 6-dimethyl phenol was designed and subsequently …

A Neural-Network-Optimized Hydrogen Peroxide Pairwise Additive Model for Classical Simulations

AR Peralta, G Odriozola - Journal of Chemical Theory and …, 2023 - ACS Publications
We have developed an all-atom pairwise additive model for hydrogen peroxide using an
optimization procedure based on artificial neural networks (ANNs). The model is based on …

Application of Near-Infrared Spectroscopy and Aquaphotomics in Understanding the Water Behavior during Cold Atmospheric Plasma Processing

J Luo, T Xu, W Ding, X Wei, H Zang, X Wang, L Li - Applied Sciences, 2023 - mdpi.com
Plasma-activated water (PAW), obtained by exposing liquid to cold atmospheric plasma
(CAP) for a period, has gained widespread attention for its potential as anti-bacterial, anti …