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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	18-Apr-2024	tCo-CN+6H2O_tdb3_augccpVDZ@ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP; TD-FC	AUG-CC-PVDZ	-1290.4461351; Eh
	18-Apr-2024	tCo-CN+6H2O_tdcamb3_ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RCAM-B3LYP; TD-FC	CC-PVDZ	-1289.7511426; Eh
	18-Apr-2024	tCo-CN+6H2O_tdb3_ccpVTZ@ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP; TD-FC	CC-PVTZ	-1290.7412709; Eh
	18-Apr-2024	tC-DEA+6H2O_tdwb_ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD; TD-FC	CC-PVDZ	-1733.2389523; Eh
	18-Apr-2024	tCo-CN+6H2O_tdb3_ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP; TD-FC	CC-PVDZ	-1290.3050095; Eh
	18-Apr-2024	tCo-CN+6H2O_tdb3_tzvp_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RB3LYP; TD-FC	TZVP	-1290.734622; Eh
	18-Apr-2024	tCo-CN+6H2O_tdb3_pc1_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP; TD-FC	GEN	-1290.0345644; Eh
	18-Apr-2024	tC-DEA+6H2O_tdwb_tzvp_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD; TD-FC	TZVP	-1733.6512117; Eh
	18-Apr-2024	tC-DEA+6H2O_tdwb_pc1_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RwB97XD; TD-FC	GEN	-1732.9313728; Eh
	18-Apr-2024	uracil+4H2O_tdb3-gd3bj_augccpVDZ@ccpVDZ_smd	Pearce, Harrison	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP; TD-FC	CC-PVDZ AUG-CC-PVDZ	-720.7866629; Eh

Results 15431-15440 of 15508 (Search time: 0.015 seconds).