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Replication Data of Kästner group for: "Determination of Accessibility and Sp... Dataset
In this dataset, all simulation data are listed. That includes all geometry optimizations and single-point calculations and the conformational sampling. Furthermore, the... -
Supplementary material for 'Probing Self-Diffusion of Guest Molecules in a Co... Dataset
This dataset contains input files and results from Grand Canonical Monte Carlo (GCMC) adsorption simulation and Molecular Dynamics (MD) Simulation. All data is presented in a... -
Replication data of the Buchmeiser group for: "Molybdenum Alkylidyne Silyloxy... Dataset
All primary data files of measurements and processed data of the journal article mentioned under related publications from the Buchmeiser group can be found here. The data... -
Replication data of C4 group for: "Oxo-Bridged Zr dimers as well-defined mode... Dataset
In this dataset, all simulation data are listed. That includes all geometry optimizations and single-point calculations. The folders are named according to the nomenclature in... -
Scripts and Data for "A Generalized Grand-Reaction-Method for Modelling the E... Dataset
Simulation scripts, simulation data and plotting scripts for the paper "A Generalized Grand-Reaction-Method for Modelling the Exchange of Weak (Polyprotic) Acids between a... -
Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical S... Dataset
This dataset contains simulation input files in GROMACS format accompanying the mentioned publication. Structure, topology, and simulation parameter files are provided for bulk... -
Replication data for: "NO as a Reagent for Topochemical Framework Transformat... Dataset
This dataset contains all data from analytical measurements including FT-IR and UV-Vis spectra, raw XRD patterns, 1H, 13C and 15N solution and ssNMR spectra, Ar, CO2, and NO... -
Replication data of Lotsch group for: "Direct and Linker-Exchange Alcohol-Ass... Dataset
Covalent organic frameworks (COFs) are an extensively studied class of porous materials, which distinguish themselves from other porous polymers in their crystallinity and high... -
Replication data for: "Olefin Metathesis in Confinement: Towards Covalent Org... Dataset
Covalent organic frameworks (COFs) offer vast structural and chemical diversity enabling a wide and growing range of applications. While COFs are well-established as... -
Replication data for: "Interlayer Interactions as Design Tool for Large-Pore ... Dataset
ABSTRACT: Covalent organic frameworks (COFs) with a pore size beyond 5 nm are still rarely seen in this emerging field. Besides obvious complications like the elaborated... -
Replication data for: "In Situ Monitoring of Mechanochemical Covalent Organic... Dataset
Covalent organic frameworks (COFs) have emerged as a new class of molecularly precise, porous functional materials characterized by broad structural and chemical versatility,... -
Material for the paper "The possible role of lipid bilayer properties in the ... Dataset
Simulation input scripts to produce the data presented in the manuscript "The possible role of lipid bilayer properties in the evolutionary disappearance of betaine lipids in... -
Replication Data for: "A flavin-inspired covalent organic framework for photo... Dataset
Covalent organic frameworks (COFs) offer a number of key properties that predestine them to be used as heterogeneous photocatalysts, including intrinsic porosity, long-range... -
Data for "Ordered Mesoporous Carbons via Self-Assembly of Tailored Block Copo... Dataset
Data for "Ordered Mesoporous Carbons via Self-Assembly of Tailored Block Copolyethers for Pore Size-Dependent Applications" is reported. The data is structured according to... -
Data for "Lewis Pair Polymerization of Epoxides via Zwitterionic Species as a... Dataset
A dual catalytic setup based on N‐heterocyclic olefins (NHOs) and magnesium bis(hexamethyldisilazide) (Mg(HMDS)2) was used to prepare poly(propylene oxide) with a molar mass... -
Replication data of Lotsch group for: "Rational Design of Covalent Cobaloxime... Dataset
All primary data files of measurements and processed data of the journal article mentioned under related publications from Lotsch group can be found here. This dataset contains... -
Replication data of Lotsch group for: "Sustained Solar H2 Evolution from a Th... Dataset
All primary data files of measurements and processed data of the journal article mentioned under related publications from Lotsch group can be found here. This dataset contains... -
Data for "Controlled Synthesis of “Reverse Pluronic”-Type Block Copolyethers ... Dataset
The data is structured according to tables (and specific table entries) and schemes in the research article and contains the following data types: NMR raw data, GPC raw data,... -
Publication data for: "Probing the Interactions of Immobilized Ruthenium Dihy... Dataset
This file contains all the characterization and reactivity data for our publication given in the title. This includes all catalyst characterization data (NMR, IR, and XAS data)... -
Publication data for: "3D Sub-Nanometer Analysis of Glucose in an Aqueous Sol... Dataset
All primary data files and processed data of the journal article. DFT calculations to the fragmentation of glucose cations to explain the peaks in the APT mass spectrum. Glucose...
