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Journal of Physics. Condensed Matter : an Institute of Physics Journal|February 7, 2022
H<sub>2</sub>O<sub>2</sub>adsorption and dissociation on various CeO<sub>2</sub>(111) surface models: a first-principles studyLuca Brugnoli, Shingo Urata, Alfonso PedoneThe Journal of Physical Chemistry. A|June 21, 2021
Development and Application of a ReaxFF Reactive Force Field for Cerium Oxide/Water InterfacesLuca Brugnoli, Maria Cristina Menziani, Shingo Urata, et al.Langmuir : the ACS Journal of Surfaces and Colloids|April 8, 2023
New Atomistic Insights on the Chemical Mechanical Polishing of Silica Glass with Ceria NanoparticlesLuca Brugnoli, Katsuaki Miyatani, Masatoshi Akaji, et al.Langmuir : the ACS Journal of Surfaces and Colloids|March 20, 2024
Impact of Atomic Defects on Ceria Surfaces on Chemical Mechanical Polishing of Silica Glass SurfacesMirko Di Biase, Luca Brugnoli, Katsuaki Miyatani, et al.The Journal of Chemical Physics|May 21, 2022
Biasing crystallization in fused silica: An assessment of optimal metadynamics parametersFederica Lodesani, Maria Cristina Menziani, Shingo Urata, et al.The Journal of Physical Chemistry Letters|February 2, 2023
Evidence of Multiple Crystallization Pathways in Lithium Disilicate: A Metadynamics InvestigationFederica Lodesani, Maria Cristina Menziani, Shingo Urata, et al.Journal of Chemical Theory and Computation|August 11, 2018
Assessment of Density Functional Approximations for Highly Correlated Oxides: The Case of CeO<sub>2</sub> and Ce<sub>2</sub>O<sub>3</sub>Luca Brugnoli, Anna Maria Ferrari, Bartolomeo Civalleri, et al.Scientific Reports|February 21, 2020
Structural origins of the Mixed Alkali Effect in Alkali Aluminosilicate Glasses: Molecular Dynamics Study and its AssessmentFederica Lodesani, Maria Cristina Menziani, Hiroyuki Hijiya, et al.Scientific Reports|October 21, 2020
Disclosing crystal nucleation mechanism in lithium disilicate glass through molecular dynamics simulations and free-energy calculationsFederica Lodesani, Maria Cristina Menziani, Kei Maeda, et al.The Journal of Chemical Physics|December 16, 2019
An efficient computational procedure to obtain a more stable glass structureShingo UrataPageof 11