potassium alanate is one of the goal candidates for hydrogen storage during past decades. in this report, initially the density functional theory was applied to simulate the electronic and structural characteristic of the experimentally known kalh4 complex hydride. the relaxation of unit cell parameters and atomic positions was performed until the total residual force reduced less than 0.001ev ...

Hydrogen is considered to be the most promising new energy carrier to replace fossil fuels. The use of hydrogen in practical applications such as fuel cell driven vehicles and portable-devices, however, requires the development of safe and efficient hydrogen storage technologies/materials. High-pressure (>35 MPa) and cryogenic (< 20 K) hydrogen storage technologies may not be so practical for t...

Mg-based materials have been investigated as hydrogen storage materials, especially for possible onboard storage in fuel cell vehicles for decades. Recently, with the development of large-scale fuel cell technologies, the development of Mg-based materials as stationary storage to supply hydrogen to fuel-cell components and provide electricity and heat is becoming increasingly promising. In this...

Advancement in hydrogen storage techniques represents one of the most important areas of today's materials research. While extensive efforts have been made to the existing techniques, there is no viable storage technology capable of meeting the DOE cost and performance targets at the present time. New materials with significantly improved hydrogen adsorption capability are needed. Microporous m...

Widespread adoption of hydrogen as a vehicular fuel depends critically upon the ability to store hydrogen on-board at high volumetric and gravimetric densities, as well as on the ability to extract/insert it at sufficiently rapid rates. As current storage methods based on physical means--high-pressure gas or (cryogenic) liquefaction--are unlikely to satisfy targets for performance and cost, a g...