A copy of this work was available on the public web and has been preserved in the Wayback Machine. The capture dates from 2017; you can also visit the original URL.
The file type is
Proceedings of the 2011 TeraGrid Conference on Extreme Digital Discovery - TG '11
In this paper we review the main features and illustrate the use of VLab, a Science Gateway that provides Cyberinfrastructure (CI) for distributed first principles computations in materials science. The VLab CI includes Web Services running in different computers, controlled from a Web Portal running predefined, distributed, and interactive workflows by multiple users. Currently, in addition to simple electronic structure calculations, it supports calculations of materials properties importantdoi:10.1145/2016741.2016777 fatcat:ykswhygbwzgpxi3jt2bvfetro4