Electrocatalysis in alkaline media and alkaline membrane-based energy technologies
Hydrogen energy-based electrochemical energy conversion technologies offer the promise
of enabling a transition of the global energy landscape from fossil fuels to renewable energy …
of enabling a transition of the global energy landscape from fossil fuels to renewable energy …
How water's properties are encoded in its molecular structure and energies
How are water's material properties encoded within the structure of the water molecule? This
is pertinent to understanding Earth's living systems, its materials, its geochemistry and …
is pertinent to understanding Earth's living systems, its materials, its geochemistry and …
Nuclear quantum effects in water and aqueous systems: Experiment, theory, and current challenges
Nuclear quantum effects influence the structure and dynamics of hydrogen-bonded systems,
such as water, which impacts their observed properties with widely varying magnitudes. This …
such as water, which impacts their observed properties with widely varying magnitudes. This …
Protons and hydroxide ions in aqueous systems
Understanding the structure and dynamics of water's constituent ions, proton and hydroxide,
has been a subject of numerous experimental and theoretical studies over the last century …
has been a subject of numerous experimental and theoretical studies over the last century …
Free energy of proton transfer at the water–TiO 2 interface from ab initio deep potential molecular dynamics
TiO2 is a widely used photocatalyst in science and technology and its interface with water is
important in fields ranging from geochemistry to biomedicine. Yet, it is still unclear whether …
important in fields ranging from geochemistry to biomedicine. Yet, it is still unclear whether …
Probing the self-ionization of liquid water with ab initio deep potential molecular dynamics
M Calegari Andrade, R Car… - Proceedings of the …, 2023 - National Acad Sciences
The chemical equilibrium between self-ionized and molecular water dictates the acid–base
chemistry in aqueous solutions, yet understanding the microscopic mechanisms of water self …
chemistry in aqueous solutions, yet understanding the microscopic mechanisms of water self …
Hydroxide diffuses slower than hydronium in water because its solvated structure inhibits correlated proton transfer
Proton transfer via hydronium and hydroxide ions in water is ubiquitous. It underlies acid–
base chemistry, certain enzyme reactions, and even infection by the flu. Despite two …
base chemistry, certain enzyme reactions, and even infection by the flu. Despite two …
The mechanism of proton conduction in phosphoric acid
Neat liquid phosphoric acid (H3PO4) has the highest intrinsic proton conductivity of any
known substance and is a useful model for understanding proton transport in other …
known substance and is a useful model for understanding proton transport in other …
Proton transfer through the water gossamer
A Hassanali, F Giberti, J Cuny… - Proceedings of the …, 2013 - National Acad Sciences
The diffusion of protons through water is understood within the framework of the Grotthuss
mechanism, which requires that they undergo structural diffusion in a stepwise manner …
mechanism, which requires that they undergo structural diffusion in a stepwise manner …
Stimuli‐responsive supramolecular hydrogels and their applications in regenerative medicine
J Hoque, N Sangaj, S Varghese - Macromolecular bioscience, 2019 - Wiley Online Library
Supramolecular hydrogels are a class of self‐assembled network structures formed via non‐
covalent interactions of the hydrogelators. These hydrogels capable of responding to …
covalent interactions of the hydrogelators. These hydrogels capable of responding to …