Electronic, structural, and optical properties of crystalline yttriavan der Waals Interactions on the Mesoscale: Open-Science Implementation, Anisotropy, Retardation, and Solvent Effects.Electronic structures, total energies, and optical properties of alpha -rhombohedral B12 and alpha -tetragonal B50 crystals.Spectroscopic imaging of electron energy loss spectra using ab initio data and function field visualization.Optically anisotropic infinite cylinder above an optically anisotropic half space: Dispersion interaction of a single-walled carbon nanotube with a substrateAtomic picture of elastic deformation in a metallic glass.Theoretical nonlinear response of complex single crystal under multi-axial tensile loadingSpectral mixing formulations for van der Waals-London dispersion interactions between multicomponent carbon nanotubes.X-ray absorption near edge structure/electron energy loss near edge structure calculation using the supercell orthogonalized linear combination of atomic orbitals method.Impact of Hydrogen Bonding in the Binding Site between Capsid Protein and MS2 Bacteriophage ssRNA.Optical properties and electronic transitions of DNA oligonucleotides as a function of composition and stacking sequence.Quantum mechanical metric for internal cohesion in cement crystals.Electronic structure, dielectric response, and surface charge distribution of RGD (1FUV) peptide.Accurate redetermination of the X-ray structure and electronic bonding in adenosylcobalamin.Dielectric response variation and the strength of van der Waals interactions.High-resolution spectroscopy of bonding in a novel BeP2N4 compound.The Hydration Effect and Selectivity of Alkali Metal Ions on Poly(ethylene glycol) Models in Cyclic and Linear Topology.Ab Initio Modeling of Structure and Properties of Single and Mixed Alkali Silicate Glasses.Complex interplay of interatomic bonding in a multi-component pyrophosphate crystal: K2Mg (H2P2O7)2·2H2O.Implication of the solvent effect, metal ions and topology in the electronic structure and hydrogen bonding of human telomeric G-quadruplex DNA.Electronic structure and partial charge distribution of Doxorubicin in different molecular environments.Dependence of DNA electronic structure on environmental and structural variations.Grain boundary strengthening in alumina by rare earth impurities.Ab initio simulation of elastic and mechanical properties of Zn- and Mg-doped hydroxyapatite (HAP).High sensitivity of the positron-density distribution to the K doping in C60.The electronic structure and spectroscopic properties of 3C, 2H, 4H, 6H, 15R and 21R polymorphs of SiCDeformation behavior of an amorphous zeolitic imidazolate framework - from a supersoft material to a complex organometallic alloyMetallic Ternary Telluride with Sphalerite SuperstructureElectronic structure and physical properties of the spinel-type phase of BeP2N4from all-electron density functional calculationsLong range interactions in nanoscale scienceDispersion interactions between optically anisotropic cylinders at all separations: Retardation effects for insulating and semiconducting single-wall carbon nanotubesvan der Waals–London dispersion interactions for optically anisotropic cylinders: Metallic and semiconducting single-wall carbon nanotubesCharge distribution and hydrogen bonding of a collagen α2 -chain in vacuum, hydrated, neutral, and charged structural modelsDisentangling the Effects of Shape and Dielectric Response in van der Waals Interactions between Anisotropic BodiesDependence of the strength of van der Waals interactions on the details of the dielectric response variationOptical Properties and van der Waals-London Dispersion Interactions in Inorganic and Biomolecular AssembliesChirality-dependent properties of carbon nanotubes: electronic structure, optical dispersion properties, Hamaker coefficients and van der Waals–London dispersion interactionsCalculating van der Waals-London dispersion spectra and Hamaker coefficients of carbon nanotubes in water from ab initio optical propertiesCritical point analysis of the interband transition strength of electronsOptical properties of a near- axis tilt grain boundary in
P50
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P50
description
onderzoeker
@nl
physicist and researcher
@en
հետազոտող
@hy
name
Wai-Yim Ching
@ast
Wai-Yim Ching
@en
Wai-Yim Ching
@es
Wai-Yim Ching
@sl
type
label
Wai-Yim Ching
@ast
Wai-Yim Ching
@en
Wai-Yim Ching
@es
Wai-Yim Ching
@sl
prefLabel
Wai-Yim Ching
@ast
Wai-Yim Ching
@en
Wai-Yim Ching
@es
Wai-Yim Ching
@sl
P108
P214
P244
P1053
B-4686-2009
P106
P21
P214
P244
P31
P3829
P496
0000-0001-7738-8822
P7859
lccn-n96010028