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Browsing bySubjectdensity functional theory
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Showing results 1 to 7 of 7
Issue Date
Title
Author(s)
Type
2020
Ab Initio-Based Structural and Thermodynamic Aspects of the Electrochemical Lithiation of Silicon Nanoparticles
이상헌
Article
2021
Correlation between Electronic Configuration and Magnetic Stability in Dysprosium Single Atom Magnets
Fabio Donati; Christoph Wolf
Article
2024
Electronic structure of 1,3-diphenyl-2-azaallenyl radical cation
박지훈
Article
2023
Energy Landscapes for Lithium Incorporation and Diffusion in Multidomain Silicon Suboxide Anode Materials
이상헌
Article
2016
Impact of d-Band Occupancy and Lattice Contraction on Selective Hydrogen Production from Formic Acid in the Bimetallic Pd3M (M = Early Transition 3d Metals) Catalysts
이상헌
Article
2019
Large effect of metal substrate on magnetic anisotropy of Co on hexagonal boron nitride
Fabio Donati
Article
2023
On the magnetic bistability of small iron clusters used in scanning tunneling microscopy tip preparation
Christoph Wolf
Article
1
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