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Quantitative Assessment of Halogen Bonding Utilizing Vibrational Spectroscopy.Correlating the vibrational spectra of structurally related molecules: A spectroscopic measure of similarity.Characterizing Chemical Similarity with Vibrational Spectroscopy: New Insights into the Substituent Effects in Monosubstituted Benzenes.The Many Facets of Chalcogen Bonding: Described by Vibrational Spectroscopy.Systematic Coupled Cluster Study of Noncovalent Interactions Involving Halogens, Chalcogens, and Pnicogens.Recovering Intrinsic Fragmental Vibrations Using the Generalized Subsystem Vibrational Analysis.Quantitative Assessment of Tetrel Bonding Utilizing Vibrational SpectroscopyPushing 3c-4e Bonds to the Limit: A Coupled Cluster Study of Stepwise Fluorination of First-Row AtomsIn Situ Measure of Intrinsic Bond Strength in Crystalline Structures: Local Vibrational Mode Theory for Periodic SystemsQuantitative Assessment of B-B-B, B-Hb -B, and B-Ht Bonds: From BH3 to B12 H12 2Interplay of Ring Puckering and Hydrogen Bonding in DeoxyribonucleosidesMetal-Halogen Bonding Seen through the Eyes of Vibrational SpectroscopyA new way of studying chemical reactions: a hand-in-hand URVA and QTAIM approachModified Density Functional Dispersion Correction for Inorganic Layered MFX Compounds (M = Ca, Sr, Ba, Pb and X = Cl, Br, I)Systematic description of molecular deformations with Cremer-Pople puckering and deformation coordinates utilizing analytic derivatives: Applied to cycloheptane, cyclooctane, and cyclo[18]carbonA Critical Evaluation of Vibrational Stark Effect (VSE) Probes with the Local Vibrational Mode Theory
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P50
description
researcher ORCID ID = 0000-0002-9658-5626
@en
wetenschapper
@nl
name
Elfi Kraka
@ast
Elfi Kraka
@en
Elfi Kraka
@es
Elfi Kraka
@nl
type
label
Elfi Kraka
@ast
Elfi Kraka
@en
Elfi Kraka
@es
Elfi Kraka
@nl
prefLabel
Elfi Kraka
@ast
Elfi Kraka
@en
Elfi Kraka
@es
Elfi Kraka
@nl
P106
P31
P496
0000-0002-9658-5626