Analysis and evaluation of machine learning applications in materials design and discovery

The Chemistry and Applications of Metal-Organic Frameworks

Hiroyasu Furukawa, Kyle E. Cordova, M. O’Keeffe et al. · Science · 2013 · 16.5K citations

Natural Sciences, Chemistry, Materials Science +16

Commentary: The Materials Project: A materials genome approach to accelerating materials innovation

Anubhav Jain, Shyue Ping Ong, Geoffroy Hautier et al. · APL Materials · 2013 · 12.7K citations · Full text

Natural Sciences, Materials Engineering, Materials Science +17

Recent development of two-dimensional transition metal dichalcogenides and their applications

Wonbong Choi, Nitin Choudhary, Gang Han et al. · Materials Today · 2017 · 2.7K citations · Full text

Natural Sciences, Materials Engineering, Materials Science +15

Crystal Graph Convolutional Neural Networks for an Accurate and Interpretable Prediction of Material Properties

Tian Xie, Jeffrey C. Grossman · Physical Review Letters · 2018 · 2.6K citations · Full text

Natural Sciences, Materials Engineering, Materials Science +17

Materials Design and Discovery with High-Throughput Density Functional Theory: The Open Quantum Materials Database (OQMD)

James E. Saal, Scott Kirklin, Muratahan Aykol et al. · JOM · 2013 · 2.5K citations

Natural Sciences, Materials Science, Physics +16