Won June Kim
0000-0001-6421-9237
Changwon National University
13 papers found
Refreshing results…
Gold(I)–Thiolate Coordination Polymers as Multifunctional Materials: The Case of Au(I)–p-Fluorothiophenolate
Theoretical study of the microscopic origin of magnetocrystalline anisotropy in Fe16N2 and its alloys: comparison with the other L10 alloys
Electronic Structure of Heavy Halogen Atoms Adsorbed on the Cu(111) Surface: A Combined ARPES and First Principles Calculations Study
Benchmarking the performance of approximate van der Waals methods for the structural and energetic properties of SiO2 and AlPO4 frameworks
Electronic Structure and Band Alignments of Various Phases of Titania Using the Self-Consistent Hybrid Density Functional and DFT+U Methods
Cluster Expansion Method for Simulating Realistic Size of Nanoparticle Catalysts with an Application in CO2 Electroreduction
First-Principles Studies on Twinnability of Magnesium Alloys: Effects of Yttrium and Lithium on $\left( {10\bar{1}1} \right)\left[ {\bar{1}012} \right]$ 10 1 ¯ 1 1 ¯ 012
Benchmarking several van der Waals dispersion approaches for the description of intermolecular interactions
Failure of Density Functional Dispersion Correction in Metallic Systems and Its Possible Solution Using a Modified Many-Body Dispersion Correction
Tuned Chemical Bonding Ability of Au at Grain Boundaries for Enhanced Electrochemical CO2 Reduction
First-Principles Study of the α-β Phase Transition of Ferroelectric Poly(vinylidene difluoride): Observation of Multiple Transition Pathways
Recent development of atom-pairwise van der waals corrections for density functional theory: From molecules to solids
Density functional study of α-β phase transition of polyvinylidene difluoride
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