Zobrazeno 1 - 10
of 13
pro vyhledávání: '"Faisal A. Al-Odail"'
Publikováno v:
Scientific Reports, Vol 11, Iss 1, Pp 1-16 (2021)
Abstract The rate coefficients for OH + CH3OH and OH + CH3OH (+ X) (X = NH3, H2O) reactions were calculated using microcanonical, and canonical variational transition state theory (CVT) between 200 and 400 K based on potential energy surface construc
Externí odkaz:
https://doaj.org/article/04207e106238429098750d6171da1112
Publikováno v:
Scientific Reports, Vol 11, Iss 1, Pp 1-16 (2021)
Scientific Reports
Scientific Reports
The rate coefficients for OH + CH3OH and OH + CH3OH (+ X) (X = NH3, H2O) reactions were calculated using microcanonical, and canonical variational transition state theory (CVT) between 200 and 400 K based on potential energy surface constructed using
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cd33cfe5f67b433101b64af60c350fe2
https://doaj.org/article/04207e106238429098750d6171da1112
https://doaj.org/article/04207e106238429098750d6171da1112
Autor:
SK Safdar Hossain, Junaid Saleem, M. Mudassir Ahmad Alwi, Faisal A. Al‐Odail, Mohammad Mozahar Hossain
Publikováno v:
Chemical record (New York, N.Y.). 22(7)
Direct formic acid fuel cells (DFAFCs) have gained immense importance as a source of clean energy for portable electronic devices. It outperforms other fuel cells in several key operational and safety parameters. However, slow kinetics of the formic
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cba13eaf9a02571f971deee41d8c2ee9
https://pubmed.ncbi.nlm.nih.gov/35733082
https://pubmed.ncbi.nlm.nih.gov/35733082
Publikováno v:
SSRN Electronic Journal.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c09b2ca6392b13c9c62442097ab3a323
https://doi.org/10.2139/ssrn.4045850
https://doi.org/10.2139/ssrn.4045850
Publikováno v:
Structural Chemistry. 29:1085-1094
The present work reports a theoretical study of vibrational signatures of the photochromic molecular transformation between two photochromic heterocyclic isomers. Raman and infrared (IR) spectra of the E (ring-opened form) and C (ring-closed form) ph
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::38c817df5c731043cbbf7ed907db5715
https://doi.org/10.1007/s11224-018-1093-5
https://doi.org/10.1007/s11224-018-1093-5
Publikováno v:
Computational and Theoretical Chemistry. 1125:103-111
The geometries, stabilities, electronic and magnetic properties of small PdnAg (n = 1–8) clusters have been estimated within the frame work of density functional theory (DFT) at B3P86/LANL2DZ level of theory. Various possible geometries have been e
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::deef3033c45778b0a880ca86e8b0daab
https://doi.org/10.1016/j.comptc.2018.01.005
https://doi.org/10.1016/j.comptc.2018.01.005
Publikováno v:
Electrocatalysis. 8:340-350
Here is a first study of the electrocatalytic oxidation of glucose by nickel phosphate nano/micro particles (NiPh) modified glassy carbon electrode (NiPh/GC). The NiPh is fabricated by a simple reflux method. The morphology and structure of the NiPh
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::67e2dbbf088155b9ed0d75e5e61ba14f
https://doi.org/10.1007/s12678-017-0376-8
https://doi.org/10.1007/s12678-017-0376-8
Publikováno v:
Journal of Molecular Liquids. 225:919-925
Nanoparticles of nickel oxide (nano-NiOx) have been synthesized using electrochemical and sol-gel routes. Impacts of the synthesis route on the structural and electrochemical properties of NiOx nanoparticles modified glassy carbon electrode (nano-NiO
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a1810271823add855a6117e08707ff5a
https://doi.org/10.1016/j.molliq.2016.11.018
https://doi.org/10.1016/j.molliq.2016.11.018
Publikováno v:
Bulletin of the Chemical Society of Japan. 89:1455-1461
The present work is dedicated to study the performance of H2/Air proton exchange membrane (PEM) fuel cells (FC) by using an empirical modeling and experimental results at symmetric and asymmetric r...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1ac98fcd3845c5baefcb4fb95a4011b6
https://doi.org/10.1246/bcsj.20160259
https://doi.org/10.1246/bcsj.20160259
Autor:
Faisal A. Al-Odail, Javed Mazher
Publikováno v:
Computational and Theoretical Chemistry. 1063:63-69
OH effects on the hydrogen oxidation reaction, during a metallic surface electrocatalysis, have been studied by using density functional theory (DFT) based first principles methods. The hydrogen reaction is carried out on Pd(1 1 1) surface with the h
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::86263be221e4114219c03ca0ecb11d2d
https://doi.org/10.1016/j.comptc.2015.03.026
https://doi.org/10.1016/j.comptc.2015.03.026