Search Results - "Schulze, Jessica A."
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eReaxFF force field development for BaZr0.8Y0.2O3-δ solid oxide electrolysis cells applications
Published in npj computational materials (28-06-2024)“…The use of solid-oxide materials in electrocatalysis applications, especially in hydrogen-evolution reactions, is promising. However, further improvements are…”
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Investigation of Mechanical Properties in PVA Hydrogels Due to Cation Interactions Described by Reactive Forcefield Based Molecular Dynamics Simulations
Published in JOM (1989) (01-12-2022)“…Hydrogels are cross-linked networks containing water and are widely used in multiple fields due to their intrinsic softness and diffusive properties. One field…”
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Effect of Salts on the Formation and Hypervelocity-Induced Fragmentation of Icy Clusters with Embedded Amino Acids
Published in ACS earth and space chemistry (19-01-2023)“…The search for biomolecules via flyby or orbiting missions is prime for hypervelocity sampling where there is a water-rich plume or exosphere that can be…”
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On the Origin of Nonclassical Ripples in Draped Graphene Nanosheets: Implications for Straintronics
Published in ACS applied nano materials (26-08-2022)“…Ever since the discovery of graphene and subsequent explosion of interest in single-atom-thick materials, studying their mechanical properties has been an…”
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On the origin of non-classical ripples in draped graphene sheets
Published 25-12-2019“…Ever since the discovery of graphene and subsequent explosion of interest in single atom thick materials, studying their mechanical properties has been an…”
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