UTChem is a research product of our work to develop new and better theoretical methods in quantum chemistry. UTChem is a research product of our work to develop new and better theoretical methods in quantum chemistry.ĪB - UTChem is a quantum chemistry software developed by Hirao's group at the University of Tokyo. N2 - UTChem is a quantum chemistry software developed by Hirao's group at the University of Tokyo. We further parallelize the geochemistry module of UTCHEM-IPhreeqc in order to conduct field scale reservoir simulations. The model is a multiphase, multi-component, three-dimensional finite-difference simulator. T1 - UTChem - A program for ab initio quantum chemistryĬopyright 2020 Elsevier B.V., All rights reserved. Invention Description UTCHEM can be used to simulate a wide range of displacement processes at both the field and laboratory scales.
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