Efficient anharmonic lattice dynamics calculations of thermal transport in crystalline and disordered solids G Barbalinardo, Z Chen, NW Lundgren, D Donadio Journal of Applied Physics 128 (13), 2020 | 44 | 2020 |
Ultrahigh Convergent Thermal Conductivity of Carbon Nanotubes from Comprehensive Atomistic Modeling D Barbalinardo, Giuseppe, Chen, Zekun, Dong, Haikuan, Fan, Zheyong, Donadio Phys. Rev. Lett. 127 (2), 025902, 2021 | 30 | 2021 |
Bathochromic Shift in the UV–visible absorption spectra of phenols at ice surfaces: insights from first-principles calculations FC Bononi, Z Chen, D Rocca, O Andreussi, T Hullar, C Anastasio, ... The Journal of Physical Chemistry A 124 (44), 9288-9298, 2020 | 29 | 2020 |
Photodecay of guaiacol is faster in ice, and even more rapid on ice, than in aqueous solution T Hullar, FC Bononi, Z Chen, D Magadia, O Palmer, T Tran, D Rocca, ... Environmental Science: Processes & Impacts 22 (8), 1666-1677, 2020 | 24 | 2020 |
Effect of crystallinity and thickness on thermal transport in layered PtSe2 A El Sachat, P Xiao, D Donadio, F Bonell, M Sledzinska, A Marty, ... npj 2D Materials and Applications 6 (1), 32, 2022 | 15 | 2022 |
UV–visible absorption spectra of solvated molecules by quantum chemical machine learning Z Chen, FC Bononi, CA Sievers, WY Kong, D Donadio Journal of Chemical Theory and Computation 18 (8), 4891-4902, 2022 | 9 | 2022 |
Enhanced photodegradation of dimethoxybenzene isomers in/on ice compared to in aqueous solution T Hullar, T Tran, Z Chen, F Bononi, O Palmer, D Donadio, C Anastasio Atmospheric Chemistry and Physics 22 (9), 5943-5959, 2022 | 8 | 2022 |
Thermodynamics of water and ice from a fast and scalable first-principles neuroevolution potential Z Chen, ML Berrens, KT Chan, Z Fan, D Donadio Journal of Chemical & Engineering Data 69 (1), 128-140, 2023 | 7 | 2023 |
Mattersim: A deep learning atomistic model across elements, temperatures and pressures H Yang, C Hu, Y Zhou, X Liu, Y Shi, J Li, G Li, Z Chen, S Chen, C Zeni, ... arXiv preprint arXiv:2405.04967, 2024 | 6 | 2024 |
Reversible doping and photo patterning of polymer nanowires ZI Bedolla‐Valdez, R Xiao, C Cendra, AS Fergerson, Z Chen, G Gonel, ... Advanced Electronic Materials 6 (10), 2000469, 2020 | 6 | 2020 |
Solvation Structure and UV–Visible Absorption Spectra of the Nitrate Anion at the Air–Ice Interface by First-Principles Molecular Simulations ML Berrens, Z Chen, KT Chan, C Anastasio, D Donadio ACS Earth and Space Chemistry 7 (9), 1761-1769, 2023 | 3 | 2023 |
Barbalinardo et al. Reply G Barbalinardo, Z Chen, H Dong, Z Fan, D Donadio Physical Review Letters 128 (25), 259602, 2022 | 3 | 2022 |
The Stability and Dynamics of Zeolite-Confined Gold Nanoclusters S Sonti, C Sun, Z Chen, R Kowalski, J Kowalski, D Donadio, SH Ahn, ... | | 2024 |