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Title: oxpoconazole_CONF64_gas
Authors: Pla Terrada, Paula
Issue Date: 10-Feb-2022
Publisher: Barcelona Supercomputing Center
Description: Gaussian set of calculations with B3LYP of oxpoconazole CONF64 in gas
URI: https://iochem-bd.bsc.es/browse/handle/100/214963
Appears in Collections:G1_other - DOI: 10.19061/iochem-bd-6-123



Please use this identifier to cite or link to this item: https://iochem-bd.bsc.es/browse/handle/100/214963

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