Zobrazeno 1 - 2
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pro vyhledávání: '"Pavel V. Bushlanov"'
Publikováno v:
The Journal of Physical Chemistry A. 125:3936-3942
C-H-N-O system is central for organic chemistry and biochemistry, and plays a major role in planetary science (dominating the composition of "ice giants" Uranus and Neptune). The inexhaustible chemical diversity of this system at normal conditions ex
Publikováno v:
Computer Physics Communications. 236:1-7
Crystal structure prediction is a new dynamically developing field. Two main types of crystal structure prediction methods exist: (1) based on global optimization and (2) based on data mining. It seems promising to hybridize data mining and global op