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Benchmarking binding energy calculations for organic structure-directing agents in pure-silica zeolites
Sun, 2021-05-09 19:15
Daniel Schwalbe-Koda
Rafael Gómez-Bombarelli
Benchmarking binding energy calculations for organic structure-directing agents in pure-silica zeolites
The Journal of Chemical Physics
,
vol.
154
,
pp.
174109
,
2021
.
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