| Combinatorial molecular optimization of cement hydrates KJVVRJMP M.J. Abdolhosseini Qomi, K.J. Krakowiak, M. Bauchy, K.L. Stewart, R ... Nature Communications 5, 2014 | 486 | 2014 |
| Mesoscale texture of cement hydrates K Ioannidou, KJ Krakowiak, M Bauchy, CG Hoover, E Masoero, S Yip, ... Proceedings of the National Academy of Sciences 113 (8), 2029-2034, 2016 | 217 | 2016 |
| Fracture toughness of calcium–silicate–hydrate from molecular dynamics simulations M Bauchy, H Laubie, MJA Qomi, CG Hoover, FJ Ulm, RJM Pellenq Journal of Non-Crystalline Solids 419, 58-64, 2015 | 182 | 2015 |
| Structural, vibrational, and elastic properties of a calcium aluminosilicate glass from molecular dynamics simulations: the role of the potential M Bauchy Journal of Chemical Physics 141, 024507, 2014 | 150 | 2014 |
| Anomalous composition-dependent dynamics of nanoconfined water in the interlayer of disordered calcium-silicates MJ Abdolhosseini Qomi, M Bauchy, FJ Ulm, RJM Pellenq Journal of Chemical Physics 140 (5), 054515, 2014 | 147 | 2014 |
| Atomic scale foundation of temperature-dependent bonding constraints in network glasses and liquids M Bauchy, M Micoulaut Journal of Non-Crystalline Solids 357 (14), 2530-2537, 2011 | 146 | 2011 |
| Direct Carbonation of Ca(OH)2 Using Liquid and Supercritical CO2: Implications for Carbon-Neutral Cementation K Vance, G Falzone, I Pignatelli, M Bauchy, M Balonis, G Sant Industrial & Engineering Chemistry Research 54 (36), 8908-8918, 2015 | 136 | 2015 |
| 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 | 130 | 2017 |
| Discovery of ultra-crack-resistant oxide glasses with adaptive networks K Januchta, RE Youngman, A Goel, M Bauchy, SL Logunov, SJ Rzoska, ... Chemistry of Materials 29 (14), 5865-5876, 2017 | 128 | 2017 |
| A new transferable interatomic potential for molecular dynamics simulations of borosilicate glasses M Wang, NMA Krishnan, B Wang, MM Smedskjaer, JC Mauro, M Bauchy Journal of Non-Crystalline Solids 498, 294-304, 2018 | 127 | 2018 |
| Order and disorder in calcium–silicate–hydrate M Bauchy, MJ Qomi, FJ Ulm, RJM Pellenq The Journal of chemical physics 140 (21), 2014 | 124 | 2014 |
| 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 | 122 | 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 | 119 | 2021 |
| Rigidity transition in materials: hardness is driven by weak atomic constraints M Bauchy, MJA Qomi, C Bichara, FJ Ulm, RJM Pellenq Physical review letters 114 (12), 125502, 2015 | 115 | 2015 |
| Viscosity and viscosity anomalies of model silicates and magmas: A numerical investigation M Bauchy, B Guillot, M Micoulaut, N Sator Chemical Geology 346, 47-56, 2013 | 115 | 2013 |
| Predicting the dissolution kinetics of silicate glasses using machine learning NMA Krishnan, S Mangalathu, MM Smedskjaer, A Tandia, H Burton, ... Journal of Non-Crystalline Solids 487, 37-45, 2018 | 114 | 2018 |
| Revisiting silica with ReaxFF: Towards improved predictions of glass structure and properties via reactive molecular dynamics Y Yu, B Wang, M Wang, G Sant, M Bauchy Journal of Non-Crystalline Solids 443, 148-154, 2016 | 111 | 2016 |
| Nanoscale structure of cement: viewpoint of rigidity theory M Bauchy, MJ Abdolhosseini Qomi, C Bichara, FJ Ulm, RJM Pellenq The Journal of Physical Chemistry C 118 (23), 12485-12493, 2014 | 99 | 2014 |
| A dissolution-precipitation mechanism is at the origin of concrete creep in moist environments I Pignatelli, A Kumar, R Alizadeh, Y Le Pape, M Bauchy, G Sant The journal of chemical physics 145 (5), 2016 | 98 | 2016 |
| Structure, topology, rings, and vibrational and electronic properties of GeSe glasses across the rigidity transition: A numerical study M Micoulaut, A Kachmar, M Bauchy, S Le Roux, C Massobrio, M Boero Physical Review B 88 (5), 054203, 2013 | 97 | 2013 |
Morten M. SmedskjaerProfessor, Aalborg UniversityVerified email at bio.aau.dk
