READ ME File For 'Dataset supporting a University of Southampton Doctoral thesis: Understanding and controlling organic solid-state switches by combining variable temperature and high-pressure crystallography measurements with quantum mechanics studies'

Dataset DOI: 10.5258/SOTON/D2450

ReadMe Author: Goulielmina Anyfanti, University of Southampton 

This dataset supports the thesis entitled: Understanding and controlling organic solid-state switches by combining variable temperature and high-pressure crystallography measurements with quantum mechanics studies
AWARDED BY: Univeristy of Southampton
DATE OF AWARD: [2023]

DESCRIPTION OF THE DATA
The data is sorted into 5 different folders reflecting the number of materials studies. Each folder contains:

1)Single Crystal X-Ray diffraction Variable Temperature DATA(NameMaterial_SCXRD_VT)

2)Single Crystal X-Ray diffraction High Pressure DATA(NameMaterial_SCXRD_HP)

3)Energy studies DATA (CrystalExpl, Pixel, etc...)

4)EXCELL file for the experimental conditions

5)EXCELL file for energetic studies conditions
- DL-norlecine, DL-methionine, DL-

Selenomethionine folders contain also:

6)Powder X-Ray diffraction High Pressure DATA (NameMaterial_PWXRD_HP)

7)Equation of State DATA (NameMaterial_EoS


Date of data collection: [1/10/2018-30/06/2022]


Licence:
[CC BY]


Date that the file was created: October, 2023