Big Data in a Nano World: A Review on Computational, Data-Driven Design of Nanomaterials Structures, Properties, and Synthesis
Sign Up to like & getrecommendations! Published in 2022 at "ACS Nano"
DOI: 10.1021/acsnano.2c08411
Abstract: The recent rise of computational, data-driven research has significant potential to accelerate materials discovery. Automated workflows and materials databases are being rapidly developed, contributing to high-throughput data of bulk materials that are growing in quantity… read more here.
Keywords: nano; driven research; computational data; design ... See more keywords
Combining multiple acquisition modes and computational data annotation for structural characterization in traditional Chinese medicine: Miao Nationality medicine Qijiao Shengbai Capsule as a case study
Sign Up to like & getrecommendations! Published in 2022 at "RSC Advances"
DOI: 10.1039/d2ra04720a
Abstract: Qijiao Shengbai Capsule (QSC) is a reputable Miao Nationality medicine used for treating leukopenia, but its chemical composition has not yet been elucidated. We herein present a strategy, by integrating multiple data acquisition, computational data… read more here.
Keywords: mass; computational data; acquisition modes; annotation ... See more keywords
Exploration and development of molecule-based printed electronics materials: an integrated approach using experimental, computational, and data sciences
Sign Up to like & getrecommendations! Published in 2024 at "Science and Technology of Advanced Materials"
DOI: 10.1080/14686996.2024.2418282
Abstract: ABSTRACT The challenge in developing molecule-based electronic materials lies in the uncontrollable or unpredictable nature of their crystal structures, which are crucial for determining both electrical properties and thin-film formability. This review summarizes the findings… read more here.
Keywords: molecule; experimental computational; data sciences; computational data ... See more keywords