Ion pairing calculation python code

TypeCollection
TitleIon pairing calculation python code
Brief TitleIon pairing code
Collection TypeSoftware
Access PrivilegesColloid and Interfaces Group
DOI - Digital Object Identifier10.25911/5ee05544ca5e2
Metadata LanguageEnglish
Data LanguageEnglish
Significance StatementThis is the python code used to produce the data in Table 2 and the plots in the supplementary information
Brief DescriptionPython code for calculating ion pairing as a function of concentrations
Full DescriptionPython code for calculating ion paring within the Debye Huckel model. The electrostatic energy is compared to the thermal kinetic energy to determine the fraction of ions that are paired
Contact Emailvince.craig@anu.edu.au
Contact AddressDept of Applied Maths
84 Garran Road, Applied Mathematics Building
The Australian National University
ACT 2600 Australia
Contact Phone Number+61432832431
Principal InvestigatorVincent Craig
CollaboratorsDrew Parsons
Guangming Liu
Fields of Research030603 - Colloid and Surface Chemistry
020405 - Soft Condensed Matter
KeywordsElectrostatic decay length
Polyelectrolyte
Reentrant
Ion pairing
ion-ion correlations
Date of data creation2020
Year of data publication2020
Creator(s) for Citation
Given NameSurname
VinceCraig
Publisher for CitationThe Australian National University Data Commons
Access Rights TypeOpen
Licence TypeCC-BY-NC-SA - Attribution-NonCommercial-SharedAlike (Version 4.0)
Retention PeriodIndefinitely
Data Size8.05 KB
Data Management PlanNo
Status: Published
Published To:
- Australian National University
- Australian National Data Service
Identifier: anudc:6067
Related Items
Files

Estimates:

  • Files: 1
  • Size: 8.05 KB

Data Files

Updated:  07 February 2019/ Responsible Officer:  University Librarian/ Page Contact:  Library Systems & Web Coordinator