Fluorinated imidazoles as proton carriers for water-free fuel cell membranes
WQ Deng, V Molinero, WA Goddard - Journal of the American …, 2004 - ACS Publications
We propose an alternative new material (2, 4, 5-trifluoroimidazole impregnated Nafion) for
use as a high-temperature, water-free membrane for proton-exchange membrane fuel cells …
use as a high-temperature, water-free membrane for proton-exchange membrane fuel cells …
Single-molecule chemical reaction reveals molecular reaction kinetics and dynamics
Y Zhang, P Song, Q Fu, M Ruan, W Xu - Nature communications, 2014 - nature.com
Understanding the microscopic elementary process of chemical reactions, especially in
condensed phase, is highly desirable for improvement of efficiencies in industrial chemical …
condensed phase, is highly desirable for improvement of efficiencies in industrial chemical …
Molecular simulations of poly (2, 5‐benzimidazole): Effect of water concentration, phosphoric acid doping, and temperature on hydrogen bonding and vehicular …
Results of atomistic simulations of neat, hydrated, and phosphoric acid (PA)‐doped poly (2,
5‐benzimidazole)(ABPBI) are reported in this article, with an emphasis on the effect of water …
5‐benzimidazole)(ABPBI) are reported in this article, with an emphasis on the effect of water …
Ab Initio Study of Proton Transfer and Interfacial Properties in Phosphoric Acid‐D oped Polybenzimidazole
Quantum mechanics calculations and hybrid ab initio/empirical molecular dynamics
simulations using the ONIOM scheme have been used to investigate proton transfer and …
simulations using the ONIOM scheme have been used to investigate proton transfer and …
[图书][B] Molecular simulation of phosphoric acid-doped polybenzimidazoles as high-temperature proton exchange membranes
S Li - 2011 - search.proquest.com
Proton transfer (PT) in fuel cell membranes consists of proton hopping along the hydrogen
bond network (structural diffusion, occurs in the time scale of picoseconds) and the diffusion …
bond network (structural diffusion, occurs in the time scale of picoseconds) and the diffusion …
Simulation of Liquids
BD Todd, DJ Searles - … Modelling: Applications and Theory, Vol 4, 2006 - books.google.com
After spending a number of months reviewing the literature in this field, two inevitable and
immediate conclusions were drawn: first, the field is growing at a phenomenal rate, with …
immediate conclusions were drawn: first, the field is growing at a phenomenal rate, with …
[PDF][PDF] A Complete Bibliography of Publications in Computing in Science and Engineering
NHF Beebe - 2024 - ctan.math.utah.edu
A Complete Bibliography of Publications in Computing in Science and Engineering Page 1
A Complete Bibliography of Publications in Computing in Science and Engineering Nelson …
A Complete Bibliography of Publications in Computing in Science and Engineering Nelson …