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ONS VML Annual Busines Survey (ABS)

Annual Survey of businesses, covering production, construction, distribution and service industries.

Ab initio Molecular Dynamics Trajectories for Hydrous Silicate Melts (NERC Grant NE/P002951/1)

Ab initio trajectories for the equilibrated MgO-SiO2-H2O melts at T = 1800 K and 3000 K are provided as "XDATCAR" files output directly from VASP for each simulation interval. Corresponding stress...

Two-phase modeling of water partitioning between liquid iron and silicate melt (NERC Grant NE/S01134X/1)

The two-phase modeling of water between liquid iron and silicate melt at 50 and 135 gigapascals (corresponding to 3500 and 4200 kelvin) was performed by using ab initio molecular dynamics...

Input parameters for ab initio molecular dynamics simulations of water at non-ambient pressure and temperature using the CP2K code

This deposit consists of a readme file, which describes the file 'simulationinput.in'. This is a simple text file that contains the information necessary to run any of the ab initio molecular...

Annual Business Survey

This short story uses a snapshot of ONS’s Annual Business Survey (ABS) to look at the contribution that foreign-owned registered businesses in the UK made to the UK Non-Financial Business Economy...

Transport of Lithophile Elements in Magmatic-Hydrothermal Fluids (NERC grant NE/I02349X/1)

Supplementary material received relating to the following papers: Metal complexion and ion hydration in low density hydrothermal fluids: Ab initio molecular dynamics simulation of Cu(I) and Au(I)...

Ab initio calculations and high P-T experiments on iron, iron alloys and other materials (NERC Grant NE/M015181/1)

This collection includes the elastic calculations of the hcp-Fe-Si-S-C alloy system. NERC grant NE/M015181/1 - Pre melting in iron and iron alloys: ab initio calculations and high P-T experiments...

Annual Business Survey - Financial

ABS reports annually on UK businesses in the Agriculture (part), Production, Construction, Distribution and Service sectors. Its main variables are Turnover, Purchases, approximate Gross Value...

Joint Nature Conservation Committee (JNCC) Geophysical, Multibeam, Photo and Video Survey 2009/3_JNCC: Seabed habitat investigations: Anton Dohrn and East Rockall Bank (01/Jul/2009 to 29/Jul/2009)

This JNCC marine survey took place in July 2009 and surveyed two areas (Anton Dohrn seamount and East Rockall Bank Reef) for offshore Special Areas of Conservation (SACs). These areas are both now...

Example Elastic Calculations for ElasT Toolkit (NERC Grant NE/M000125/1)

Elastic constants were calculated by using the stress-strain method and density functional theory for crystals of different symmetry. A toolkit was developed to facilitate the input preparation and...

Water Partitioning between Liquid Iron and Silicate Melt at High Pressure and High Temperature (NERC Grant NE/M015181/1, NE/S01134X/1)

The partitioning coefficients of water between iron and silicate melts at 20, 50, 90 and 135 gigapascals (corresponding to 2800, 3500, 3900 and 4200 kelvin) were calculated by using ab initio...

Annual Business Inquiry

The Annual Business Inquiry (ABI) is conducted in two parts: employment and financial information. This release deals with the financial inquiry which collects information for about two thirds of...

Peatland stream water chemistry data from the MERLIN project, Hare Moss, Scotland, 2022-2023

This dataset comprises water chemistry data, including dissolved organic carbon (DOC), total dissolved nitrogen (TdN), particulate organic carbon (POC), total phosphorus (TP), soluble reactive...

Water chemistry and greenhouse gas emissions of UK water bodies, 2021-2022, from the LOCATE project

This dataset comprises water chemistry data for dissolved organic carbon (DOC), total dissolved nitrogen (TdN), total phosphorus (TP), soluble reactive phosphorus (SRP), absorbance at 254nm (Abs...

Density Functional Theory Calculations of Rare Earth Systems (NERC Grant NE/M01147X/1)

This data set contains example input and output files from density functional theory calculations of rare earth systems, using the Vienna Ab initio Simulation Package (VASP), The data set it split...

U-Pb isotopic data for Chelyabinsk meteorite phosphates (NERC Grant NE/L002507/1)

U-Pb isotope ratio data set for numerous phosphate (apatite) grains in two thin section samples of the LL5 S4-6 Chelyabinsk meteorite. One section is of the S4-6 light lithology, and another of the...

Log file, GSAS data files and diffraction patterns from synchrotron experiments on NaMnF3 (NERC grant NE/J009520/1)

Log file and GSAS data files for synchrotron study of NaMnF3. Diffraction patterns from synchrotron experiments on NaMnF3. NERC grant: Understanding the D' zone: novel fluoride analogues to MgSiO3...

Leading linear growth rates for steady uniform morphodynamic overland flows at different Froude numbers and grain diameters (NERC Grant NE/S00274X/1)

Shallow overland flows in steady state can become unstable and break up into destructive surges. The following data documents maximum growth rates for disturbances to uniform steady flows on a...

Melting in the Deep Earth (NERC grants NE/I010734/1 and NE/I010947/1)

Published paper from grant NE/I010734/1, Modeling the melting of multicomponent systems: the case of MgSiO3 perovskite under lower mantle conditions by Cono Di Paola and John P. Brodholt doi:...