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Sc-Computation-Paper-in-Carbon-2022
Raw data and supplementary Info for the Computational paper about Sc adsorbates on Diamond, published in Carbon 2022 -
Ylide solvation dynamics
Time resolved infrared (TRIR) spectroscopy and computational chemistry data for photolytic production of ylides in organic solvents and their subsequent solvation dynamics. -
Data from Drewitt & Bromiley Front. Earth Sci. 2022
This deposit contains ab initio molecular dynamics trajectories and structural analysis data from the paper by Drewitt & Bromiley (2022) "Boron incorporation in silicate... -
Correlating Orbital Composition and Activity of LaMnxNi1-xO3 Nanostructures T...
Detailed correlation between electronic structure of transition metal oxides and their oxygen electrocatalytic activity -
Bare-earth ArcticDEM
This data is the bare-earth ArcticDEM we created for the City of Helsinki, Finland. This data repository also includes data that associates with the paper named 'Bare-earth DEM... -
FeSeS pressure CP
High-pressure study of the electrical resistivity of Fe(Se,S) single crystals with S contents just beyond the critical concentration at which nematicity is suppressed. Contains... -
A fossilised ventral ganglion reveals a chaetognath affinity for Cambrian nec...
This folder contains supporting data accompanying study of a new taxon from Sirius Passet, Nektognathus evasmithae. -
Data from Sun et al. 2021. Ultrastructure and in-situ chemical characterizati...
This dataset contains three dimensional X-Ray tomographic datasets of fossil specimens of Megasphaera from the Ediacaran Weng'an Biota, 54 Quarry, Weng'an County, Guizhou... -
FABDEM Vietnam
A building and forest removed Digital Elevation Model called FABDEM for Vietnam -
A Multiscale Workflow for Modelling Ligand Complexes of Zinc Metalloproteins
Representative MD trajectories, topologies and input files for the protein:ligand complexes presented in the paper Yang et al. J Chem. Inf. Model. 2021. -
Crystallography and QM/MM Simulations Identify Preferential Binding of Hydrol...
MD trajectories, topologies, parameters and input files for the data presented in the paper Twidale et al. J Chem. Inf. Model. 2021. -
Quantum Enhanced Precision Estimation of Transmission with Bright Squeezed Light
Experimental data relating to the manuscript “Quantum Enhanced Precision Estimation of Transmission with Bright Squeezed Light” -
Thermal stress reduces carbonate production of benthic foraminifera and chang...
The data accompanies the following paper: Titelboim, D., et al. (2021). " Thermal stress reduces carbonate production of benthic foraminifera and changes the material properties... -
Data for “Metamorphism obscures primary taphonomic pathways in the early Camb...
This dataset contains the photographs, scanning electron images and elemental maps of the fossil material used to interpret the paragenetic sequence for preserved labile soft... -
Data from "Probing ground state properties of the kagome antiferromagnetic He...
Simulation data generated for the paper "Probing ground state properties of the kagome antiferromagnetic Heisenberg model using the Variational Quantum Eigensolver" by Jan Lukas... -
BCB Boronate Transient Absorption Spectroscopy
Time-resolved spectra of reactive intermediates in a radical induced 1,2-metallate rearrangement reaction involving a bicylcobutyl boronate, and steady state spectra of reagents. -
Fast-Ion Conduction and Local Environments in BIMEVOX
Data sets for paper "Fast-ion conduction and local environments in BIMEVOX" by HJ Stroud, CE Mohn, J-A Hernandez and NL Allan to be published in Philosophical Transactions of... -
Coulomb explosion imaging of methyl iodide
raw data from PImMS camera from which TOF spectra and fragment ion images are constructed -
Data from Vanadzina & Schmidt 2021 ‘Developmental change during a speciation...
We use high-resolution imaging techniques to characterise change in ontogeny during a speciation event in Globorotalia plesiotumida-tumida lineage of planktic foraminifera. All... -
Data from "Solving the Hubbard model using density matrix embedding theory an...
Numerical data produced for the project "Solving the Hubbard model using density matrix embedding theory and the variational quantum eigensolver" by Lana Mineh and Ashley Montanaro