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pro vyhledávání: '"Josue E. Perez"'
Publikováno v:
Proceedings of the 2021 International Symposium on Molecular Spectroscopy.
Publikováno v:
The Journal of Physical Chemistry A. 122:9553-9562
Quantum chemistry calculations are used to investigate the energetics and kinetics of CF3OH decomposition catalyzed by a single formic acid (FA) molecule acting alone and in conjunction with a sing...
Publikováno v:
The Journal of Physical Chemistry A. 121:1022-1031
Atmospheric aerosols often contain a significant fraction of carbon-nitrogen functionality, which makes gas-phase aldehyde-amine chemistries an important source of nitrogen containing compounds in aerosols. Here we use high-level ab initio calculatio