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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	18-Apr-2024	tC-DEA+6H2O_tdpbe_augccpVDZ@ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBE1PBE; TD-FC	AUG-CC-PVDZ	-1732.1428863; Eh
	18-Apr-2024	tC-DEA+6H2O_tdcamb3_ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RCAM-B3LYP; TD-FC	CC-PVDZ	-1733.0167176; Eh
	18-Apr-2024	tC-DEA+6H2O_tdpbe_ccpVTZ@ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBE1PBE; TD-FC	CC-PVTZ	-1732.4351823; Eh
	18-Apr-2024	tC-DEA+6H2O_tdpbe_ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE; TD-FC	CC-PVDZ	-1732.0133214; Eh
	18-Apr-2024	tC-DEA+6H2O_tdcamb3_tzvp_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RCAM-B3LYP; TD-FC	TZVP	-1733.47966; Eh
	18-Apr-2024	tC-DEA+6H2O_tdcamb3_pc1_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RCAM-B3LYP; TD-FC	GEN	-1732.7557604; Eh
	18-Apr-2024	tC-DEA+6H2O_tdb3_tzvp_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RB3LYP; TD-FC	TZVP	-1734.0941404; Eh
	18-Apr-2024	tC-DEA+6H2O_tdpbe_tzvp_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBE1PBE; TD-FC	TZVP	-1732.4143325; Eh
	18-Apr-2024	tC-DEA+6H2O_tdpbe_pc1_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBE1PBE; TD-FC	GEN	-1731.6871725; Eh
	18-Apr-2024	tCo-CN+6H2O_tdpbe_augccpVDZ@ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBE1PBE; TD-FC	AUG-CC-PVDZ	-1289.0221417; Eh

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