Predicting the Young’s modulus of silicate glasses using high-throughput molecular dynamics simulations and machine learning K Yang, X Xu, B Yang, B Cook, H Ramos, NMA Krishnan, MM Smedskjaer, ... Scientific reports 9 (1), 8739, 2019 | 156 | 2019 |
Machine learning for glass science and engineering: A review H Liu, Z Fu, K Yang, X Xu, M Bauchy Journal of Non-Crystalline Solids 557, 119419, 2021 | 155 | 2021 |
Cooling rate effects in sodium silicate glasses: Bridging the gap between molecular dynamics simulations and experiments X Li, W Song, K Yang, NM Krishnan, B Wang, MM Smedskjaer, JC Mauro, ... The Journal of Chemical Physics 147 (7), 2017 | 152 | 2017 |
Prediction of the Young's modulus of silicate glasses by topological constraint theory K Yang, B Yang, X Xu, C Hoover, MM Smedskjaer, M Bauchy Journal of Non-Crystalline Solids 514, 15-19, 2019 | 46 | 2019 |
Controls on CO2 Mineralization Using Natural and Industrial Alkaline Solids under Ambient Conditions EC La Plante, I Mehdipour, I Shortt, K Yang, D Simonetti, M Bauchy, ... ACS Sustainable Chemistry & Engineering 9 (32), 10727-10739, 2021 | 45 | 2021 |
Machine learning enables rapid screening of reactive fly ashes based on their network topology Y Song, K Yang, J Chen, K Wang, G Sant, M Bauchy ACS Sustainable Chemistry & Engineering 9 (7), 2639-2650, 2021 | 27 | 2021 |
Challenges and opportunities in atomistic simulations of glasses: a review H Liu, Z Zhao, Q Zhou, R Chen, K Yang, Z Wang, L Tang, M Bauchy Comptes Rendus. Géoscience 354 (S1), 35-77, 2022 | 19 | 2022 |
Topological controls on aluminosilicate glass dissolution: Complexities induced in hyperalkaline aqueous environments T Oey, EC La Plante, G Falzone, K Yang, A Wada, M Bauchy, JW Bullard, ... Journal of the American Ceramic Society 103 (11), 6198-6207, 2020 | 18 | 2020 |
Analytical Model of the Network Topology and Rigidity of Calcium Aluminosilicate Glasses K Yang, Y Hu, Z Li, NMA Krishnan, MM Smedskjaer, CG Hoover, ... Journal of the American Ceramic Society, 2021 | 15 | 2021 |
Decoupling of indentation modulus and hardness in silicate glasses: Evidence of a shear-to densification-dominated transition M Kazembeyki, K Yang, JC Mauro, MM Smedskjaer, M Bauchy, ... Journal of Non-Crystalline Solids 553, 120518, 2021 | 14 | 2021 |
New insights into the atomic structure of amorphous TiO2 using tight-binding molecular dynamics K Yang, A Kachmar, B Wang, NM Krishnan, M Balonis, G Sant, M Bauchy The Journal of Chemical Physics 149 (9), 2018 | 14 | 2018 |
Predicting the Young’s Modulus of Silicate Glasses using High-Throughput Molecular Dynamics Simulations and Machine Learning, Sci. Rep. 9 (2019) 1–11 K Yang, X Xu, B Yang, B Cook, H Ramos, NMA Krishnan, MM Smedskjaer, ... | 6 | |
Rigidity theory of glass: Determining the onset temperature of topological constraints by molecular dynamics Y Hu, Z Liu, K Yang, NMA Krishnan, MM Smedskjaer, G Sant, M Bauchy Journal of Non-Crystalline Solids 554, 120614, 2021 | 5 | 2021 |
Predicting the young’s modulus of silicate glasses using highthroughput molecular dynamics simulations and machine learning. Sci Rep. 2019; 9 (1): 8739 K Yang, X Xu, B Yang, B Cook, H Ramos, NMA Krishnan, MM Smedskjaer, ... Springer Series in Materials Science, 0 | 5 | |
Rapid elemental extraction from ordered and disordered solutes by acoustically-stimulated dissolution S Dong, R Arnold, K Yang, EC La Plante, S Bustillos, A Kumar, B Wang, ... ACS Engineering Au 1 (2), 122-133, 2021 | 3 | 2021 |
Predicting the Young’s modulus of silicate glasses by molecular dynamics simulations and machine learning K Yang University of California, Los Angeles, 2020 | 1 | 2020 |
Topological Constraint Theory of Glass: Counting Constraints by Molecular Dynamics Simulations Y Hu, H Liu, K Yang, Q Zhou, CG Hoover, NMA Krishnan, MM Smedskjaer, ... Atomistic Simulations of Glasses: Fundamentals and Applications, 123-148, 2022 | | 2022 |
Topology-Informed Machine Learning for Predicting Glass Stiffness K Yang, B Yang, N Krishnan, CG Hoover, MM Smedskjær, M Bauchy | | 2021 |
Predicting the Young’s modulus of silicate glasses by molecular dynamics simulations and K Yang | | 2020 |
Environmental sensitivity of the topological model for aluminosilicate glass dissolution T Oey, E Callagon, K Yang, M Bauchy, J Bullard, G Sant Journal of the American Ceramic Society, 2019 | | 2019 |