Crystal structure prediction (CSP) of organic molecules is a critical task, especially in pharmaceuticals and materials science. However, conventional methods are computationally intensive and ...
14don MSN
Machine learning workflow enables faster, more reliable organic crystal structure prediction
Prediction of crystal structures of organic molecules is a critical task in many industries, especially in pharmaceuticals ...
Although occupation of dodecahedral cages by TBAB had not been previously reported, it was found that utilizing dodecahedral cages allows for higher packing density of TBAB. The results were shared in ...
The theory of the thermoelectric power of solid ionic conductors has been considered thermodynamically by Holtan, Mazur & de Groot (1953) and kinetically by Howard & Lidiard (1957a,b). In the ...
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