Title of the work: Understanding Crystal Surface Anisotropy of Organic Materials via Molecular Modelling and Facet-Specific Experimental Characterization.  

Folder Name: "Zenodo_Data".

This folder contains two subfolders: "Data_Draft" and "Data_Supporting_Information". 

The "Data_Draft" folder contains all the raw data related to the figures presented in the manuscript. Inside this folder, there are 10 subfolders, one for each figure in the manuscript. 

Folder structure: 

"Figure_1_Surface_topography" -> Surface topology of the quercetin-dimethylformamide (QDMF) crystal facets. Image obtained using Mercury software from 					 Cambridge Crystallographic Data Centre (CCDC). 

"Figure_2_ATR-FTIR" 	      -> Infrared spectra of quercetin dihydrate (QDH) (file Quercetin_dihydrate.dpt) and QDMF (file Quercetin_dmf.dpt) from 					 Attenuated Total Reflection Fourier Transform Infrared Spectroscopy (ATR-FTIR).

"Figure_3_OPTIR" 	      -> IR spectra collected for each facet of the QMDF single crystal from Optical Photothermal Infrared Spectroscopy (OPTIR). 

"Figure_4_s-SNIM_{1-10}"      -> IR spectra and topography related to the {1-10} facet from Scattering-type Scanning Near-field Infrared Microscopy (s-					 SNIM).

"Figure_5_s-SNIM_{001}"       -> IR spectra and topography related to the {001} facet from s-SNIM.

"Figure_6_s-SNIM_{001}_desolvation" -> IR spectra and topography related to the {1-10} facet after the desolvation process from s-SNIM.

"Figure_7_AFM_desolvation"    -> Topography of the facet during the desolvation process using Atomic Force Microscopy(AFM). 

"Figure_8_OPTIR_desolvation"  -> IR spectra from OPTIR collected for the {001} facet, {1-10} facet, and QDH.

"Figure_9_AM-FM_{001}"        -> Young's Modulus and topography of the {001} facet.

"Figure_10_AM-FM_{200}"       -> Young's Modulus and topography of the {200} facet. 


The "Data_Supporting_Information" folder contains all raw data used to generate the figures in the Supporting Information. Inside this folder, there are 14 subfolders, one for each figure. 

Folder structure: 

"Figure_S4_Mean_Spectra_(1-10)" -> IR spectra from OPTIR technique of (1-10) facet. 

"Figure_S5_Mean_Spectra_(001)"  -> IR spectra from OPTIR technique of (001) facet. 

"Figure_S6_Mean_Spectra_(200)"  -> IR spectra from OPTIR technique of (200) facet.

"Figure_S7_Mean_Spectra" 	-> IR spectra from OPTIR of all the facets. 

"Figure_S8_Mean_Spectra" 	-> IR spectra from OPTIR of all the facets, spectra are offset for clarity.

"Figure_S9_s-SNIM_(1-10)"	-> IR spectra and topography from s-SNIM of (1-10) facet, before desolvation.

"Figure_S10_s-SNIM_(001)"	-> IR spectra and topography from s-SNIM of (001) facet, during desolvation. 

"Figure_S11_s-SNIM_(1-10)"	-> IR spectra and topography from s-SNIM of (1-10) facet, after desolvation.

"Figure_S12_s-SNIM_(001)"       -> IR spectra and topography from s-SNIM of (001) facet, after complete desolvation.

"Figure_S13_Young_Modulus"      -> Young's modulus raw data of facet (001) and (200) from Amplitude Modulation-Frequency Modulation (AM-FM) AFM. 

"Figure_S14_Young_Modulus_(001)"-> Young's Modulus and topography of the {001} facet, map 5x5.

"Figure_S15_Young_Modulus_(001)"-> Young's Modulus and topography of the {001} facet, map 2x2.

"Figure_S16_Young_Modulus_(200)"-> Young's Modulus and topography of the {200} facet, map 5x5.

"Figure_S17_Indentation_Young-Modulus" -> Indentation and Young's modulus data by AM-FM AFM.


