Published August 13, 2019
| Version v0.4.1
Software
Open
mvdh7/pytzer: Now with carbonate and borate equilibria
Description
- Added carbonic acid and boric acid equilibrium solving;
- Eliminated module tables;
- Updated functions and parameter libraries noting that
['Cl', 'CO3']
gets sorted to['CO3', 'Cl']
; - Fixed incorrect
alph1
values for all HMW 1:(>1) electrolytes; - Added several new interaction parameter functions;
- Testing MIAMI parameter library against PM16's model:
- Adjusted numerical values to fix errors in some parameter functions:
bC_Ca_BOH4_SRM87
;bC_K_OH_MP98
;bC_Mg_BOH4_SRM87
;bC_Na_Br_MP98
;bC_Na_F_MP98
;bC_Na_HSO4_MP98
;bC_Sr_Cl_MP98
;theta_K_Sr_MP98
;
- Added new MP98 functions until numerical conflicts can be resolved:
bC_K_CO3_MP98
should follow SRG87;theta_H_K_MP98
andtheta_H_Na_MP98
should follow CMR93.
- Adjusted numerical values to fix errors in some parameter functions:
Files
mvdh7/pytzer-v0.4.1.zip
Files
(127.7 kB)
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Additional details
Related works
- Is supplement to
- https://github.com/mvdh7/pytzer/tree/v0.4.1 (URL)