SKCZTA SKCZTA SKCZTA SKCZTA SKCZTA SKCZTA SKCZTA ********************************************** ************************** ****** SUBROUTINE SKCZTA (T, CZ, SDEN, ISKWRK, RSKWRK, ACT) Returns the activities of the species, given the pressure, temperature and concentrations. INPUT T(*) - Real array, temperature(s); dimension is determined by the application program to be the total number of species temperatures, nominally 1. cgs units, K CZ(*) - Real array, gas-phase and surface species concentrations, and bulk species activities; dimension at least KKTOT, the total species count. The first KKGAS gas-phase concentrations are moles/cm**3, the next KKSURF site concentrations are moles/cm**2, and the final KKBULK entries are bulk species activities. SDEN(*) - Real array, site densities for the site types; dimension at least NPHASE, the total phase count, but the subroutine only uses site phase entries, NFSURF <= N <= NLSURF. cgs units, moles/cm**2. ISKWRK(*) - Integer workspace array; dimension at least LENISK. RSKWRK(*) - Real workspace array; dimension at least LENRSK. OUTPUT ACT(*) - Real array, activities of the species; dimension at least KKTOT, the total species count. The first KKGAS activities are mole fractions, the next KKSURF activities are site fractions (species density normalized by the site density; surface concentration in moles/cm**2 is ACT(K)*SITE_DENSITY / # sites per species), and the next KKBULK activities for bulk phase species should be from 0 to 1, and should sum to 1 for each phase.