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- 2024
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Structural characterization of E22G Aβ1-42 fibrils via1H detected MAS NMR
2024) In Physical Chemistry Chemical Physics(
- Contribution to journal › Article
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Structural characterisation of α-synuclein-membrane interactions and the resulting aggregation using small angle scattering
(
- Contribution to journal › Article
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Exploration of anion effects in solvothermal synthesis using in situ X-ray diffraction
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- Contribution to journal › Article
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Soft X-ray absorption and fragmentation of tin-oxo cage photoresists
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- Contribution to journal › Article
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An efficient method to establish electrostatic screening lengths of restricted primitive model electrolytes
(
- Contribution to journal › Article
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Conformational control of antimicrobial peptide amphiphilicity : consequences for boosting membrane interactions and antimicrobial effects of photocatalytic TiO2 nanoparticles
(
- Contribution to journal › Article
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Perspective: multi-configurational methods in bio-inorganic chemistry
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- Contribution to journal › Scientific review
- 2023
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New types of complex motion of a simple camphor boat
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- Contribution to journal › Article
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Effect of polymer addition on the phase behavior of oil-water-surfactant systems of Winsor III type
2023) In Physical Chemistry Chemical Physics(
- Contribution to journal › Scientific review
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Two-body dissociation of isoxazole following double photoionization - an experimental PEPIPICO and theoretical DFT and MP2 study
(
- Contribution to journal › Article
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A method to capture the large relativistic and solvent effects on the UV-vis spectra of photo-activated metal complexes
(
- Contribution to journal › Article
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A computational study of the reaction mechanism and stereospecificity of dihydropyrimidinase
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- Contribution to journal › Article
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Energy-dependent timescales in the dissociation of diiodothiophene dication
(
- Contribution to journal › Article
- 2022
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The cobalt oxidation state in preferential CO oxidation on CoOx/Pt(111) investigated by operando X-ray photoemission spectroscopy
(
- Contribution to journal › Article
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Probing aqueous ions with non-local Auger relaxation
(
- Contribution to journal › Article
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Electronic polarization effects on membrane translocation of anti-cancer drugs
(
- Contribution to journal › Article
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A modified Jarzynski free-energy estimator to eliminate non-conservative forces and its application in nanoparticle-membrane interactions
(
- Contribution to journal › Article
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Anion-cation contrast of small molecule solvation in salt solutions
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- Contribution to journal › Article
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Interaction of nanoparticles with lipid films : The role of symmetry and shape anisotropy
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- Contribution to journal › Article
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Core-shell excitation of isoxazole at the C, N, and O K-edges - an experimental NEXAFS and theoretical TD-DFT study
(
- Contribution to journal › Article
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Structural investigation of sulfobetaines and phospholipid monolayers at the air-water interface
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- Contribution to journal › Article
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An atomistic explanation of the ethanol-water azeotrope
(
- Contribution to journal › Article
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Soft X-ray signatures of cationic manganese-oxo systems, including a high-spin manganese(v) complex
(
- Contribution to journal › Article
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Electron transport via tyrosine-doped oligo-alanine peptide junctions : role of charges and hydrogen bonding
(
- Contribution to journal › Article
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Revealing the sensing mechanism of a fluorescent pH probe based on a bichromophore approach
(
- Contribution to journal › Article
- 2021
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Structure and dynamics of highly concentrated LiTFSI/acetonitrile electrolytes
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- Contribution to journal › Article
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Breaking inversion symmetry by protonation : Experimental and theoretical NEXAFS study of the diazynium ion, N2H+
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- Contribution to journal › Article
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Photodissociation dynamics of halogenated aromatic molecules : The case of core-ionized tetrabromothiophene
(
- Contribution to journal › Article
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Low temperature aging in a molecular glass : The case of: Cis -methyl formate
(
- Contribution to journal › Article
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Propensity, free energy contributions and conformation of primary : N -alcohols at a water surface
(
- Contribution to journal › Article
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Oxygen chemistry of halogen-doped CeO2(111)
(
- Contribution to journal › Article
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Unraveling electronic band structure of narrow-bandgap p-n nanojunctions in heterostructured nanowires
(
- Contribution to journal › Article
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Electronic structure of the [Ni(Salen)] complex studied by core-level spectroscopies
(
- Contribution to journal › Article
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Design of robust 2,2′-bipyridine ligand linkers for the stable immobilization of molecular catalysts on silicon(111) surfaces
(
- Contribution to journal › Article
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Time dependent reduced density matrix functional theory at strong correlation : Insights from a two-site Anderson impurity model
(
- Contribution to journal › Article
- 2020
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Highly efficient energy transfer from a water soluble zinc silver indium sulphide quantum dot to organic J-aggregates
(
- Contribution to journal › Article
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Investigating the influence of relativistic effects on absorption spectra for platinum complexes with light-activated activity against cancer cells
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- Contribution to journal › Article
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More than protection : The function of TiO2interlayers in hematite functionalized Si photoanodes
(
- Contribution to journal › Article
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HERFD-XANES probes of electronic structures of ironII/IIIcarbene complexes
(
- Contribution to journal › Article
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The carbon and oxygen K-edge NEXAFS spectra of CO+
(
- Contribution to journal › Article
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In situ studies of the cathodic stability of single-crystalline IrO2(110) ultrathin films supported on RuO2(110)/Ru(0001) in an acidic environment
(
- Contribution to journal › Article
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Transient IR spectroscopy identifies key interactions and unravels new intermediates in the photocycle of a bacterial phytochrome
(
- Contribution to journal › Article
- 2019
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Bayesian determination of the effect of a deep eutectic solvent on the structure of lipid monolayers
(
- Contribution to journal › Article
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Extremely large differences in DFT energies for nitrogenase models
(
- Contribution to journal › Article
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Stability and behaviour in aqueous solutions of the anionic cubic silsesquioxane substituted with tetramethylammonium
(
- Contribution to journal › Article
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Experimental and theoretical 2p core-level spectra of size-selected gas-phase aluminum and silicon cluster cations : Chemical shifts, geometric structure, and coordination-dependent screening
(
- Contribution to journal › Article
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Are crystallographic : B-factors suitable for calculating protein conformational entropy?
(
- Contribution to journal › Article
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Influence of polar co-solutes and salt on the hydration of lipid membranes
(
- Contribution to journal › Article
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Block copolymers as bile salt sequestrants : Intriguing structures formed in a mixture of an oppositely charged amphiphilic block copolymer and bile salt
(
- Contribution to journal › Article
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Molecular insight into carboxylic acid-alkali metal cations interactions : Reversed affinities and ion-pair formation revealed by non-linear optics and simulations
(
- Contribution to journal › Article