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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	13-Jan-2021	/No-Catalysis-Substrate-Assisted-Mech/4_water_extra_molecules p-NphenPhos-TS+4wat	Sanchez-Gonzalez, Angel	ADF; 2019	Transition state	BP86	TZP	-7.40709884; Eh
	13-Jan-2021	/Mo5-2pNPP-Substrate-Assisted-Mech FFM_NPPhydr_Mo5_TS1	Sanchez-Gonzalez, Angel	ADF; 2018	Transition state	BP86	TZP	-15.97485162; Eh
	13-Jan-2021	/Mo5-2pNPP-Substrate-Assisted-Mech 4wat-Mo5-2NPP-TS	Sanchez-Gonzalez, Angel	ADF; 2019	Transition state	BP86	TZP	-18.13389168; Eh
	13-Jan-2021	/Mo2-Substrate-Assited-Mech/Mo2-3wat H2O+Mo-3w-TS	Sanchez-Gonzalez, Angel	ADF; 2018	Transition state	BP86	TZP	-10.29047620; Eh
	13-Jan-2021	/Mo2-Substrate-Assited-Mech/Mo2-1wat H2O+Mo-1W-TS	Sanchez-Gonzalez, Angel	ADF; 2018	Transition state	BP86	TZP	-9.20991943; Eh
	13-Jan-2021	/Mo2-Substrate-Assited-Mech/Mo2-4wat H2O+Mo-4W-TS	Sanchez-Gonzalez, Angel	ADF; 2018	Transition state	BP86	TZP	-10.83984092; Eh
	13-Jan-2021	/W5-Substrate-Assisted-Mech W5O23-2NPP-H2O-Int	Sanchez-Gonzalez, Angel	ADF; 2018	Transition state	BP86	TZP	-16.34180038; Eh
	13-Jan-2021	/W5-Substrate-Assisted-Mech W5O23-2NPP-TS-H2O	Sanchez-Gonzalez, Angel	ADF; 2018	Transition state	BP86	TZP	-16.32682104; Eh
	13-Jan-2021	/W2-Substrate-Assisted-Mech/W2-1wat 1H2O+W2O8H4-pNPP-TransitionState	Sanchez-Gonzalez, Angel	ADF; 2019	Transition state	BP86	TZP	-9.36801405; Eh
	13-Jan-2021	/W2-Substrate-Assisted-Mech/W2-0wat W2O8H4-pNPP-TransitionState	Sanchez-Gonzalez, Angel	ADF; 2019	Transition state	BP86	TZP	-8.82222624; Eh

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