tetragonal.materials-mine.com
Heusler Database
This page is the front-end to our Heusler database. At present we are interested in the mechanism for the tetragonal distortion that occurs in a few Heuslers, as such the format of the website reflects this. The data is calculated using the VASP implementation of density functional theory (DFT), further details of the calculation can be found here. A daily sql dump of the tetragonal database is provided here. Created by Thomas Archer, Trinity College, Dublin - -.
2d.materials-mine.com
2D Database
Although graphene has captured a lot of attention recently, there are many other layered materials show similar promise. The non-chemical specific nature of the bonding between layers allows a combinatorial approach to designing new materials, similar to shuffling a deck of cards allowing the design and optimization of new materials. Database of 2D materials. Elastic binding analysis of -A-B-A-B- stacked 2D layers. Sliding energy surface calculations. Binding energy profile for layer rotation.
tutorials.materials-mine.com
Tutorials
Created By: Thomas Archer.
mrg.materials-mine.com
Heusler Database
Designing a fully-compensated half-metallic ferrimagnet. Mario Zic, Karsten Rode, Naganivetha Thiyagarajah, Yong-Chang Lau, Davide Betto, J.M.D. Coey, Stefano Sanvito, Kerry J. O'Shea, Ciaran A. Ferguson, Donald A. MacLaren and. This database is a small part of our materials database. Here we present our data on secondary phases in the Mn-Ru-Ga system, presented in our recent paper. Here we provide the data from our high-throughput investigation. A dump of the mysql MRG database is provided here.
boat.materials-mine.com
Heusler Database
Massive tunnel magnetoresistance in a all-Heusler junction: a flexible platform for new spintronics devices. Worasak Rotjanapittayakul, Jariyanee Prasongkit, Ivan Rungger, Stefano Sanvito, Wanchai Pijitrojana and. Proposing a new junction from theory is a long way from demonstrating it in reality, there are many processes at the interface that we will not know until someone attempts to make it. Here we present a study of the secondary phases and their relative stability for the Fe-Al-F-Bi system.
