1 Computer Network Information Centre, Chinese Academy of Sciences, Beijing 100190, China;
2 University of Chinese Academy of Sciences, Beijing 100049, China
MatCloud provides a high-throughput computational materials infrastructure for the integrated management of materials simulation, data, and computing resources. In comparison to AFLOW, Material Project, and NoMad, MatCloud delivers two-fold functionalities:a computational materials platform where users can do on-line job setup, job submission and monitoring only via Web browser, and a materials properties simulation database. It is developed under Chinese Materials Genome Initiative and is a China own proprietary high-throughput computational materials infrastructure. MatCloud has been on line for about one year, receiving considerable registered users, feedbacks, and encouragements. Many users provided valuable input and requirements to MatCloud. In this paper, we describe the present MatCloud, future visions, and major challenges. Based on what we have achieved, we will endeavour to further develop MatCloud in an open and collaborative manner and make MatCloud a world known China-developed novel software in the pressing area of high-throughput materials calculations and materials properties simulation database within Material Genome Initiative.
(Computational methods and data processing, data acquisition and storage)
Fund:
Project supported by the National Key Research and Development Program of China (Grant Nos. 2017YFB0701702 and 2016YFB0700501), the National Natural Science Foundation of China (Grant Nos. 61472394 and 11534012), and Science and Technology Department of Sichuan Province, China (Grant No. 2017JZ0001).
Corresponding Authors:
Xiaoyu Yang
E-mail: kxy@cnic.cn
Cite this article:
Xiaoyu Yang(杨小渝), Zongguo Wang(王宗国), Xushan Zhao(赵旭山), Jianlong Song(宋健龙), Chao Yu(虞超), Jiaxin Zhou(周嘉欣), Kai Li(李凯) MatCloud, a high-throughput computational materials infrastructure: Present, future visions, and challenges 2018 Chin. Phys. B 27 110301
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