eData: the STFC Research Data Repository
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Barium chlorate monohydrate
No full textInelastic Neutron Scattering spectrum of Barium chlorate monohydrate, Ba(ClO3)2.H2O, measured on the TOSCA instrument
Data supporting the publication: "Assignment of the vibrational spectra of diiron nonacarbonyl, Fe2(CO)9"
No full textInfrared, Raman and INS spectra of Fe2(CO)9 and computational studies using Gaussian09 and CASTEP (v20). All data is present as ASCII. The vibrational spectra may be visualised using any standard program e.g. Excel or Origin
1,5-Dichloropentane
No full textInelastic Neutron Scattering spectrum of 1,5-Dichloropentane, C5H10Cl2, measured on the TOSCA instrument
Aripiprazole II
No full textInelastic Neutron Scattering spectrum of Aripiprazole II, C23H27Cl2N3O2, measured on the TOSCA instrument.
7-{4-[4-(2,3-Dichlorophenyl)piperazin-1-yl]butoxy}-3,4-dihydroquinolin-2(1H)-on
Aripiprazole III
No full textInelastic Neutron Scattering spectrum of Aripiprazole III, C23H27Cl2N3O2, measured on the TOSCA instrument.
7-{4-[4-(2,3-Dichlorophenyl)piperazin-1-yl]butoxy}-3,4-dihydroquinolin-2(1H)-on
Lead acetate trideuterate
No full textInelastic Neutron Scattering spectrum of Lead acetate trideuterate, Pb(CH3CO2)2.3D2O, measured on the TOSCA instrument
Tetraamylammonium iodide
No full textInelastic Neutron Scattering spectrum of Tetraamylammonium iodide, (C5H11)4NI, measured on the TOSCA instrument
Sodium hydrogen acetate
No full textInelastic Neutron Scattering spectrum of Sodium hydrogen acetate, NaH(CH3CO2)2, measured on the TOSCA instrument.
Sodium biacetat
Methylammonium germanium trichloride
No full textInelastic Neutron Scattering spectrum of Methylammonium germanium trichloride, (CH3NH3)[GeCl3], measured on the TOSCA instrument
The Microscopic Structure of Liquid Nitric Oxide
No full textThis is the neutron data and EPSR analysis of those data that will appear soon in a publication called "The Microscopic Structure of Liquid Nitric Oxide in the Journal of Physical Chemistry B. It includes all the Gudrun input and analysis files used, plus all the EPSR analysis files, plus the files used to create the figures. A readme.txt file explains the basic file format.ISIS RB191038