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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_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_ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE; TD-FC	CC-PVDZ	-1732.0133214; Eh
	18-Apr-2024	tCo-CN+6H2O_tdwb_ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD; TD-FC	CC-PVDZ	-1289.9129804; Eh
	18-Apr-2024	tCo-CN+6H2O_tdpbe_ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE; TD-FC	CC-PVDZ	-1288.899931; Eh
	18-Apr-2024	tCo-CN+6H2O_tdcamb3_pc1_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RCAM-B3LYP; TD-FC	GEN	-1289.4873034; Eh
	18-Apr-2024	tCo-CN+6H2O_tdwb_pc1_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD; TD-FC	GEN	-1289.606966; Eh
	18-Apr-2024	tCo-CN+6H2O_tdpbe_pc1_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE; TD-FC	GEN	-1288.5783945; Eh
	18-Apr-2024	tC-MeO+4dioxane_tdb3-gd3bj_augccpVDZ@ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP; TD-FC	CC-PVDZ AUG-CC-PVDZ	-2407.9389445; Eh
	18-Apr-2024	adenine+6H2O_tdb3-gd3bj_augccpVDZ@ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RB3LYP; TD-FC	CC-PVDZ AUG-CC-PVDZ	-926.2349445; Eh
	18-Apr-2024	ABN+8H2O_tdb3-gd3bj_augccpVDZ@ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP; TD-FC	CC-PVDZ AUG-CC-PVDZ	-1510.7165971; Eh

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