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pro vyhledávání: '"Shannon E. Harold"'
Autor:
Jonas Elm, Daniel Ayoubi, Morten Engsvang, Andreas Buchgraitz Jensen, Yosef Knattrup, Jakub Kubečka, Conor J. Bready, Vance R. Fowler, Shannon E. Harold, Olivia M. Longsworth, George C. Shields
Publikováno v:
WIREs Computational Molecular Science.
Autor:
Shannon E. Harold, Conor J. Bready, Leah A. Juechter, Luke A. Kurfman, Sara Vanovac, Vance R. Fowler, Grace E. Mazaleski, Tuguldur T. Odbadrakh, George C. Shields
Publikováno v:
The Journal of Physical Chemistry A. 126:1718-1728
We explored the hypothesis that on the nanoscale level, acids and bases might exhibit different behavior than in bulk solution. Our study system consisted of sulfuric acid, formic acid, ammonia, and water. We calculated highly accurate Domain-based L