“…5 However, the mechanism of the T-H exchange reaction with HTO is still poorly understood. Furthermore, HTO creates hydrogen bonding interaction in the system, therefore, the reaction of organic molecules would be different and likely more complex from that with T 2 .…”
“…5 However, the mechanism of the T-H exchange reaction with HTO is still poorly understood. Furthermore, HTO creates hydrogen bonding interaction in the system, therefore, the reaction of organic molecules would be different and likely more complex from that with T 2 .…”
“…Despite the validity of theoretical approaches, only a few theoretical researches have been published so far. 5 Quite recently, Dong and coworkers studied hydrogen-tritium (H-T) exchange reactions between small organic and T 2 ( ref. 8 ) or HTO 5 molecules using density functional theory (DFT).…”
The mechanism of hydrogen-tritium (H-T) exchange reactions between several small organic and HTO molecules have been investigated using M06-2X/6-311++G(d,p) method.
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