Prediction of new compounds in the AHal-BHal3 systemsстатья
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Дата последнего поиска статьи во внешних источниках: 26 августа 2016 г.
Аннотация:Yet-nonsynthesized compounds of the compositions A2BHal5, A3BHal6, and ABHal4 in systems of mono- and trivalent metal halides were predicted, and so was the type of their crystal structure under normal conditions. The calculations were performed by precedent-based pattern recognition methods using a special system for computer design of inorganic compounds. The new compounds were predicted using only the data on the properties of constituent elements and simple halides