Hydrogen as a clean fuel is becoming vital in view of depleting fossil fuels and ever increasing energy demand. Hence hydrogen generation and storage gains immense …
S Sarfaraz, M Yar, K Ayub - International Journal of Hydrogen Energy, 2024 - Elsevier
The development of low-cost, and highly active catalysts for electrocatalytic hydrogen evolution process is of great interest. Exohedral first row transition metal doped fullerenes …
Numerous studies associated with carbon-based materials have shown excellent results for the adsorption of important molecules. Bearing in mind that hydrogen is important as an …
H2 storage and capture are critical components in the development of clean and sustainable hydrogen energy. The current work investigates the H2 adsorption properties and storage …
The Globe's frightening pace of unfavourable environmental effects is a direct outcome of the increasing dependency on fossil fuels, which depletes energy supplies and drives the …
We investigate the influence of sumanene modifications on its adsorption properties towards the hydrogen molecule. The benzylic positions of sumanene were substituted with boron …
MK Dash, S Das, S Giri, GC De… - Journal of the Indian …, 2021 - Elsevier
This article illustrates the H 2 trapping potential of Li doped tri heteroatomic six-membered aromatic Triazine isomers. The Li doped Triazine isomers are stabilized as a cation with …
H Mondal, PK Chattaraj - Journal of Computational Chemistry, 2024 - Wiley Online Library
CO2 reduction is appealing for the long‐term production of high‐value fuels and chemicals. Herein, using density functional theory (DFT) based calculations, we study the CO2 …
C Gend, R Konda, A Chaudhari - Polyhedron, 2023 - Elsevier
The hydrogen adsorption properties of Tetrahedral Silsesquioxane Si 4 O 6 H 4 (TS) cages doped with Be, Li, Sc and Ti atoms are studied in different spin state using density functional …