Computational discovery of Metal-Organic Frameworks for sustainable energy systems: Open challenges. - Xiangyu Yin 004; Chrysanthos E. Gounaris (Comput. Chem. Eng., 2022)

MatOpt: A Python Package for Nanomaterials Design Using Discrete Optimization. - Christopher L. Hanselman; Xiangyu Yin 004; David C. Miller; Chrysanthos E. Gounaris (J. Chem. Inf. Model., 2022)