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Kersti Hermansson

Uppsala University(SE)

Publications by Year

Research Areas

Spectroscopy and Quantum Chemical Studies, Advanced Chemical Physics Studies, Catalytic Processes in Materials Science, Solid-state spectroscopy and crystallography, Catalysis and Oxidation Reactions

Most-Cited Works

→ Blue-Shifting Hydrogen Bonds(2002)434 cited
→ X-Ray Charge Densities and Chemical Bonding(1998)384 cited
→ Tuning LDA+U for electron localization and structure at oxygen vacancies in ceria(2007)368 cited
→ Hydration of the Calcium Ion. An EXAFS, Large-Angle X-ray Scattering, and Molecular Dynamics Simulation Study(2000)366 cited
→ A foundation model for atomistic materials chemistry(2023)236 cited
→ A Roadmap for Transforming Research to Invent the Batteries of the Future Designed within the European Large Scale Research Initiative BATTERY 2030+(2022)212 cited
→

Development and Validation of a ReaxFF Reactive Force Field for Cu Cation/Water Interactions and Copper Metal/Metal Oxide/Metal Hydroxide Condensed Phases

(2010)

185 cited

→ Water adsorption on stepped ZnO surfaces from MD simulation(2009)158 cited

→ A reactive force field (ReaxFF) for zinc oxide(2008)154 cited

→ Ab Initio Study of Cooperativity in Water Chains: Binding Energies and Anharmonic Frequencies(1994)141 cited