Theoretical study of gas-phase detoxication of DMMP and DMPT using ammonia-borane and its analogous compound
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The detoxication of DMMP (Dimethyl methylphosphonate) and DMPT (O, S-dimethyl methylphosphonothiolate) via hydrogenation have been investigated computationally employing density functional theory (DFT). In this present study, we aim to explore the direct molec... ...
