1138 34 15944 2 52673 document 15944 Data.zip application/zip b02f2ed06bc6657dc3df5026767435d6 MD5 664552 2022-04-15 09:53:08 https://researchdata.bath.ac.uk/1138/1/Data.zip 1138 1 1 application/zip other Processed neutron diffraction data files supporting "Neutron diffraction study of indole solvation in deep eutectic systems of choline chloride, malic acid, and water" en public cc_by

Data.zip

data archive 513 disk0/00/00/11/38 2022-05-09 08:14:49 2024-07-22 10:51:39 2022-05-09 08:14:49 data_collection show Hammond Oliver O.S.Hammond@bath.ac.uk 0000-0002-5612-9343 University of Bath; Stockholm University FALSE Atri Ria R.Atri@bath.ac.uk 0000-0002-9439-8982 University of Bath FALSE Bowron Daniel T daniel.bowron@stfc.ac.uk 0000-0002-4557-1929 ISIS Neutron and Muon Source FALSE Edler Karen K.Edler@bath.ac.uk 0000-0001-5822-0127 University of Bath TRUE CG0020 dept_chem_eng dept_chem differential neutron scattering cross section, deep eutectic solvent, indole The data are in three-column text files (x, y, error in y), with a 14 line header including sample and experimenter names. This dataset includes neutron diffraction data from samples of indole in choline chloride:malic acid deep eutectic solvent in the presence and absence of water. The data has been processed using the program Gudrun to remove background scattering and instrumental effects, (creating .mint01 files) so it is ready for use in data fitting. The text files contain a header describing the name of the sample, the experimenters, and then three columns: Q (x-axis), differential scattering cross section (y-axis), error in intensity. 2022-05-05 University of Bath public This dataset includes neutron diffraction data from samples of indole in choline chloride:malic acid deep eutectic solvent in the presence and absence of water which has been corrected for backgrounds and instrumental effects. RightsHolder University of Bath Engineering and Physical Sciences Research Council https://doi.org/10.13039/501100000266 EP/L016354/1 EPSRC Centre for Doctoral Training in Sustainable Chemical Technologies cent_sus_tech Solutions of indole in choline chloride:malic acid deep eutectic solvent were prepared using h- or d-choline chloride, and h- or d-malic acid. The solutions were loaded into TiZr cuvettes, sealed and attached to the sample changer at 25C. Neutron scattering data was collected using the NIMROD instrument at the ISIS Neutron and Muon Source, UK. The raw neutron diffraction data files are available from the ISIS Neutron and Muon Source Data Journal under the title "Denitrogenation of fuel oils using hydrated choline chloride:malic acid DES". Raw data was processed to remove backgrounds and instrumental factors, to create the .mint01 files containing differential scattering cross-section against Q. The Gudrun software (https://www.isis.stfc.ac.uk/Pages/Gudrun.aspx) was used to process the data. en 1 10.15125/BATH-01138 https://doi.org/10.1002/chem.202200566 pub https://doi.org/10.5286/ISIS.E.RB1720287 data open