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Inorganic Chemistry

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PhD dissertation: Improving salt weathering resistance of hydraulic mortars with an encapsulated crystallisation inhibitor
Posted on 2024-09-17
Rubber & Elastomer Development for MArtian enviRonmental applicationS (RED 4 MARS)
Posted on 2023-05-25
PhD data
Posted on 2023-05-04

All datasets

Data underlying the PhD thesis: Temperature-chemistry-microstructure correlations for alkali-activated binders
Posted on 2025-01-27
Data underlying the article: Reshapable Magnetic Particles for Morphology-Controlled Soft Systems
Posted on 2025-02-07
Data underlying the publication: Data-driven virtual screening of conformational ensembles of transition-metal complexes
Posted on 2025-04-30
Data underlying the publication: Unveiling the Impact of Ligand Configurations and Structural Fluxionality on Virtual Screening of Transition-Metal Complexes
Posted on 2025-06-11
Sodium borohydride (NaBH4) mechanochemical regeneration dataset
Posted on 2025-06-12
Data underlying the article: Reshapable Magnetic Particles for Morphology-Controlled Soft Systems
Posted on 2025-04-23
Data underlying the PhD thesis: Reaction cascades coupled to surface-chemical nanoscale patterns.
Posted on 2025-04-28
Digital Soil Maps underlying the publication "high-resolution digital soil mapping of amorphous iron- and aluminium-(hydr)oxides to guide sustainable phosphorus and carbon management"
Posted on 2024-02-29
Data underlying the publication: On the Oxidation State of Single-Atom Re/TiO2 Hydrogenation Catalysts: A Computational Study
Posted on 2024-09-17
Dataset for "Deposition and Corrosion Performance of Phosphate-Polylactic Acid Composite Coatings on WE43 Magnesium Alloy"
Posted on 2024-01-31
Data underlying the article: Numerical Model to Simulate Electrochemical Charging of Nanocrystal Films
Posted on 2023-09-19
Dataset for "Multisine impedimetric monitoring with an in-depth distribution of relaxation times analysis of WE43 and AZ31 magnesium alloys corrosion"
Posted on 2024-02-02
Data underlying the article: A Water-free In Situ HF Treatment of InP Quantum Dots
Posted on 2023-10-10
Data underlying the publication: Mapping Spatial and Temporal Electrochemical Activity of Water and CO2 Electrolysis on Gas-Diffusion Electrodes Using Infrared Thermography
Posted on 2024-03-28
Data underlying the study: Addition of iron does not ameliorate sulfide toxicity by sargassum influx to mangroves but dampens methane and nitrous oxide emissions
Posted on 2023-09-22
Research data underlying the PhD thesis "Exploring the Feasibility of Electrochemical Ammonia Synthesis: From Lab-Scale to Production Plant"
Posted on 2024-05-28
Data underlying the publication 'Interaction of Zn with ferrihydrite and its cooperative binding in the presence of PO4'
Posted on 2024-02-05
Dataset accompanying "Revealing cellular (poly)sulphide storage in electrochemically active sulphide oxidising bacteria using rotating disc electrodes"
Posted on 2024-05-29
Data underlying the publication 'Solid-solution partitioning of micronutrients Zn, Cu and B'
Posted on 2024-02-05
Data Underlying the Publication: Homogeneous Catalysis in Plastic Waste Upcycling: A DFT Study on the Role of Imperfections in Polymer Chains
Posted on 2023-09-29
Data underlying the publication 'Boron Adsorption to Ferrihydrite with Implications for Surface Speciation in Soils: Experiments and Modeling'
Posted on 2024-02-05
Complete dataset for the publication: MACE: Automated Assessment of Stereochemistry of Transition Metal Complexes and its Applications in Computational Catalysis
Posted on 2024-02-19
Data underlying the publication: Revealing catalyst-substrate interactions in Rh-catalyzed hydrogenation with methyl 2-acetamido-acrylate and bidentate phosphine ligands
Posted on 2024-02-20
Data underlying the publication: Probing Machine Learning Models Based on High-Throughput Experimentation Data for the Discovery of Asymmetric Hydrogenation Catalysts
Posted on 2024-07-18
Data underlying the publication: Revealing catalyst-substrate interactions in Rh-catalyzed hydrogenation with methyl 2-acetamido-acrylate and bidentate phosphine ligands
Posted on 2024-03-08
Data underlying the publication: Impact of Model Selection and Conformational Effects on the Descriptors for In Silico Screening Campaigns: a Case Study of Rh-Catalyzed Acrylate Hydrogenation
Posted on 2024-04-16
Source, documentation, tests: MACE: Automated Assessment of Stereochemistry of Transition Metal Complexes and its Applications in Computational Catalysis
Posted on 2024-02-19
Data underlying the publication: Advanced ceramics in radical filtration: TiO2 layer thickness effect on the photocatalytic membrane performance
Posted on 2023-02-13
Dataset for Basic Promotors Impact Thermodynamics and Catalyst Speciation in Homogeneous Carbonyl Hydrogenation
Posted on 2022-04-29
Data underlying the publication: Solvent-mediated outer-sphere CO2 electro-reduction mechanism over Ag111 surface
Posted on 2022-03-03
Data underlying the research of: Combining Metal-Metal Cooperativity, Metal-Ligand Cooperativity and Chemical Non-Innocence in Diiron Carbonyl Complexes
Posted on 2021-09-30
Data underlying the research of: A Well-Defined Anionic Dicopper(I) Monohydride Complex that Reacts like a Cluster
Posted on 2022-02-11
Data underlying the publication: Photocatalytic ceramic membrane: Effect of the illumination intensity and distribution
Posted on 2022-12-06
Data underlying the publication: Effects of the Water Matrix on the Degradation of Micropollutants by a Photocatalytic Ceramic Membrane
Posted on 2022-10-18
Data underlying the publication: Observation of the quantized motion of excitons in CdSe nanoplatelets
Posted on 2022-02-10
Data underlying the publication: Photoexcitation of PbS nanosheets leads to highly mobile charge carriers and stable excitons
Posted on 2022-02-08
Data underlying the research of: Persistence of a Ru3(µ-CO)3(CO)5 cluster bound to a PNNP ‘expanded pincer’ ligand in different protonation states
Posted on 2022-03-01
Raw data for "Two step activation of Ru-PN3P pincer catalysts for CO2 hydrogenation"
Posted on 2022-03-22
Data underlying the research of: E-selective Semi-hydrogenation of Alkynes by a Diruthenium Hydride Complex
Posted on 2022-06-09
Data underlying the research of: Quantification of the steric properties of 1,8-naphthyridine based ligands in dinuclear complexes
Posted on 2022-09-05
Raw data for paper "Manganese-mediated C-C bond formation: alkoxycarbonylation of organoboranes"
Posted on 2021-02-24
ABC-Salt WP 3.2 Data underlying the publication: Hydrolysis of eutectic compositions in the ZnCl2:KCl:NaCl ternary system and effect of adding ZnO
Posted on 2020-11-30
Complete dataset for publication: Robust and Efficient Hydrogenation of Carbonyl Compounds Catalysed by Mixed Donor Mn(I) Pincer Complexes
Posted on 2021-05-12
ABC-Salt_WP 3.2_Data underlying the publication: Hydrolysis of eutectic compositions in the ZnCl2:KCl:NaCl ternary system and effect of adding ZnO.xlsx
Posted on 2020-11-30
Complete dataset for the publication "Composition- and Condition-Dependent Kinetics of Homogeneous Ester Hydrogenation by Mn-based Catalyst"
Posted on 2020-11-26
Complete dataset for publication: Metal-ligand cooperative activation of HX (X=H, Br, OR) bond on Mn based pincer complexes
Posted on 2021-05-12
Data underlying the publication: ChemSpaX: Exploration of Chemical Space by Automated Functionalization of Molecular Scaffold
Posted on 2021-10-04
Data underlying the publication: ChemSpaX: Exploration of Chemical Space by Automated Functionalization of Molecular Scaffold
Posted on 2021-12-01
Data underlying the publication: ChemSpaX: Exploration of Chemical Space by Automated Functionalization of Molecular Scaffold
Posted on 2021-06-14
Data underlying the research of: Tuning the Bonding of a µ-Mesityl Ligand on Dicopper(I) through a Proton-Responsive Expanded PNNP Pincer Ligand
Posted on 2019-11-20
Data underlying the research of: Cooperative H2 Activation on Dicopper(I) Facilitated by Reversible Dearomatization of an 'Expanded PNNP Pincer' Ligand
Posted on 2019-09-13
Data from Figures in the paper: Method for the Detailed Characterization of Cosputtered Inorganic Luminescent Material Libraries
Posted on 2020-05-12
Data underlying the research of: Unexpected Reactivity of a PONNOP ‘Expanded Pincer’ Ligand
Posted on 2020-03-18
Data from the PhD thesis "Sustainable Battery Materials"
Posted on 2023-05-10
Data accompanying the publication: 3D Nickel Electrodes for Hybrid Battery and Electrolysis Devices
Posted on 2024-11-08
Data underlying the publication: Simultaneous Recycling of Spent LiFePO4 and LiNixMnyCozO2 Li‑Ion Batteries Under Mild Leaching Conditions
Posted on 2025-05-13
Dataset of AFM data for "Cadmium-free electron transport layers for hydrothermally processed semitransparent Sb2S3 solar cells"
Posted on 2025-03-24
Data underlying the dissertation "Potential for light emission-Investigations into quantum dots as phosphors and in light-emitting electrochemical cells"
Posted on 2024-10-29
Data pertaining to the paper Encapsulated crystallisation inhibitor as a long-term solution to mitigate salt damage in hydraulic mortars
Posted on 2024-07-29
Data underlying the publication: Disorder-mediated ionic conductivity in irreducible solid electrolytes
Posted on 2024-09-30
Data underlying the publication: A Closer Look at Lithium-Ion Batteries in E-waste and the Potential for a Universal Hydrometallurgical Recycling Process
Posted on 2024-07-29
Data underlying the publication: Disorder-mediated ionic conductivity in irreducible solid electrolytes
Posted on 2024-09-20
Data underlying the publication: Guilty as Charged: The Role of Undercoordinated Indium in Electron-Charged Indium Phosphide Quantum Dots
Posted on 2024-08-21
Data pertaining to the paper Salt weathering resistance of mortars with an encapsulated crystallisation inhibitor
Posted on 2024-05-21
Data underlying the paper: Plasmonic Enhancement of Protein Function
Posted on 2024-08-16
Data underlying the publication: Compositional flexibility in irreducible antifluorite electrolytes for next generation battery anodes
Posted on 2024-10-22
Data underlying the publication: Who is in charge? A spectroelectrochemical study on InP based QD films
Posted on 2024-08-26