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List of works by Anne-Marie Kelterer

A QM/MM analysis of the conformations of crystalline sucrose moieties

article

A theoretical study on trivalent europium: from the free ion to the water complex

scientific article published on December 2014

Ab initio study of cationic polymeric membranes in water and methanol

Anharmonicity of Vibrational Modes in Hydrogen Chloride-Water Mixtures

scientific article published on 15 March 2019

Application of the Quantum Cluster Equilibrium (QCE) model for the liquid phase of primary alcohols using B3LYP and B3LYP-D DFT methods

scientific article published on 18 March 2011

Bis(mesitoyl)phosphinic acid: photo-triggered release of metaphosphorous acid in solution

scientific article published on 19 July 2016

Charge-Transfer Salts of 6,6-Dicyanopentafulvenes: From Topology to Charge Separation in Solution

scientific article published on 10 August 2018

Competing Intramolecular Hydrogen Bond Strengths and Intermolecular Interactions in the 4-Aminobutanol-Water Complex

scientific article published on 22 October 2018

Computational and experimental studies on the triplet states of various N-substituted 4,5,6,7-tetrachlorophthalimides.

scientific article published on 4 July 2014

Constructing and evaluating energy surfaces of crystalline disaccharides.

scientific article published in April 2000

Coordination of methanol clusters to benzene: a computational study

scientific article published on 01 September 2011

Effect of the polar–nonpolar liquid mixtures on pervaporative behavior of perfluorinated sulfonic membranes in lithium form

scientific article published in November 2016

Erratum: QM/MM distortion energies in di- and oligosaccharides complexed with proteins

article

Exciton Coupling and Conformational Changes Impacting the Excited State Properties of Metal Organic Frameworks

scientific article published on 15 September 2020

HF/6-31G* energy surfaces for disaccharide analogs

scientific article published in 2000

Infrared absorption of methanol-water clusters (CH3OH)n(H2O), n = 1-4, recorded with the VUV-ionization/IR-depletion technique.

scientific article

Insights into the Hydrogen-Atom Transfer of the Blue Aroxyl.

scientific article

Installing lactone chain termini during photoinduced polymerization

article published in 2018

Interplay of Intermolecular and Intramolecular Hydrogen Bonds on Complex Formation: The 3-Aminopropanol-Water van der Waals Complex.

scientific article published on 10 August 2017

Long wavelength absorbing carbostyrils as test cases for different TDDFT procedures and solvent models.

scientific article published on 17 April 2014

On Complex Formation between 5-Fluorouracil and β-Cyclodextrin in Solution and in the Solid State: IR Markers and Detection of Short-Lived Complexes by Diffusion NMR

scientific article published on 03 December 2020

QM/MM distortion energies in di- and oligosaccharides complexed with proteins

article

Quantum Mechanics Studies of the Intrinsic Conformation of Trehalose

scientific article published in May 2002

Spectroscopic behavior of loratadine and desloratadine in different aqueous media conditions studied by means of TD-DFT calculations.

scientific article published on 19 June 2013

Structural properties of methanol-water binary mixtures within the quantum cluster equilibrium model.

scientific article published on 9 February 2015

Sulfonic Membrane Sorption and Permeation Properties: Complementary Approaches to Select a Membrane for Pervaporation.

scientific article published on 09 August 2017

Systematic Assessment of the Photochemical Stability of Photoinitiator-Derived Macromolecular Chain Termini

scholarly article by Andrea Lauer et al published 20 November 2015 in Macromolecules

The Chemistry of Acylgermanes: Triacylgermenolates Represent Valuable Building Blocks for the Synthesis of a Variety of Germanium-Based Photoinitiators

scientific article published on 29 September 2020

The Effect of Protonation on the Optical Properties of Conjugated Fluorene-Pyridine Copolymers

Theoretical studies on the dimerization of substituted paraphenylenediamine radical cations

scientific article published on 31 August 2011

Theoretical study of structure, electronic properties, and photophysics of cyano-substituted thiophenes and terthiophenes.

scientific article published on 7 October 2008

Unprecedented Bifunctional Chemistry of Bis(acyl)phosphane Oxides in Aqueous and Alcoholic Media

scientific article published on 12 June 2019

Wavelength-Dependent Photochemical Stability of Photoinitiator-Derived Macromolecular Chain Termini

scholarly article by Andrea Lauer et al published 16 August 2017 in ACS Macro Letters

Wavelength-Dependent Photochemistry of Oxime Ester Photoinitiators

When anomeric effects collide

article

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