2022-06 | Fast atomic structure optimization with on-the-fly sparse Gaussian process potentials * | Hajibabaei, Amir; Umer, Muhammad; Anand, Rohit; Ha, Miran; Kim, Kwang S. | ARTICLE | 46 |
2021-12 | Late Transition Metal Doped MXenes Showing Superb Bifunctional Electrocatalytic Activities for Water Splitting via Distinctive Mechanistic Pathways | Anand, Rohit; Nissimagoudar, Arun S.; Umer, Muhammad; Ha, Miran; Zafari, Mohammad; Umer, Sohaib; Lee, Geunsik; Kim, Kwang S. | ARTICLE | 128 |
2022-03 | Machine learning assisted high-throughput screening of transition metal single atom based superb hydrogen evolution electrocatalysts | Umer, Muhammad; Umer, Sohaib; Zafari, Mohammad; Ha, Miran; Anand, Rohit; Hajibabaei, Amir; Abbas, Ather; Lee, Geunsik; Kim, Kwang S. | ARTICLE | 174 |
2022-05 | Unveiling the Role of Charge Transfer in Enhanced Electrochemical Nitrogen Fixation at Single-Atom Catalysts on BX Sheets (X = As, P, Sb) | Zafari, Mohammad; Umer, Muhammad; Nissimagoudar, Arun S.; Anand, Rohit; Ha, Miran; Umer, Sohaib; Lee, Geunsik; Kim, Kwang S. | ARTICLE | 143 |