Version 3 represents a major new release. The interface code has been completely rewritten in VB.NET. The download and installation procedures have changed, and a number of new options has also been introduced. Since this is a beta version, everything is not yet fully functional. This includes some of the adsorption isotherm options (Langmuir, Temkin, Langmuir-Freundlich and NICA). The help file has been updated, and a new user guide is being written; an early draft is included in the download. Below there is a list of all major changes compared to version 2.6:
Installer and file locations. Version 3 comes with a different installer, which should (in most cases) work more reliably than the old installer. The default location of the downloaded files is in the Program Files folder. When starting the application for the first time, the user will be asked where he/her would like to have the user-editable files located. The default location is in the My Documents folder.
Species tableau. A new table presents the species added to the problem in the form of a tableau, which includes information on the stoichiometry, log K and reaction enthalpy of each species. This tableau is accessible from the component list page. At present the tableau does not include surface species or species from organic complexation models.
Option to add a component as an element. A frequently asked question from users has been why it has not been possible to add, for example, arsenate as As(V) (i.e. as arsenic, with a molecular weight as for elemental As) rather than as AsO4-3, which is the standard component for As(V). This is now possible. It means, for example, that you can import As(V) data from Excel when data are given in ug/l As. Previously you had to recalculate such data to a molar unit before Excel import.
More flexibility for predefined adsorption models. On page 2 of the default parameters menu (accessible from Parameters – Various default settings), users can now define their own parameter sets for surface complexation models (SCM:s). This greatly facilitates parameter input when you are working with any other SCM parameter sets than those included in the download package. The parameter sets are saved as a special text file, ‘admodel.txt’, so that the parameter sets can be shared easily between different users.
Different functionality of the adsorption isotherms. The adsorption isotherms remained an underdeveloped part of the 2.xx versions of Visual MINTEQ. It was possible to define many isotherms, but with the important restriction that the dissolved entity of the adsorbate had to be supplied as its free ion activity. Commonly, however, adsorption isotherms are defined using the total dissolved concentration of the adsorbate. From version 3.0, only the linear Kd and Freundlich-type models are included in Visual MINTEQ. For these models it is possible to choose between the free ion activity and the total dissolved concentration as the basis of the calculations.
Saturation indexes for minerals in sweep problems. It is now possible to choose to have the saturation indexes of different minerals listed in the sweep output file.