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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	3-May-2019	bp86-Co-16-H2O-II	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Geometry optimization Minimum	UBP86	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1765.76085449; Eh
	3-May-2019	bp86-Co-16-H2O-II-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UBP86	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1765.76085449; Eh
	3-May-2019	bp86-Co-16-OH-III	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Geometry optimization Minimum	RBP86	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1765.15919353; Eh
	3-May-2019	bp86-Co-16-OH-III-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	RBP86	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1765.15919352; Eh
	3-May-2019	b3lyp-Co-16-H2O-II	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Geometry optimization Minimum	UB3LYP	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1765.70468173; Eh
	3-May-2019	b3lyp-Co-16-H2O-II-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UB3LYP	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1765.70468173; Eh
	3-May-2019	b3lyp-Ru-2-H2O-II-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	RB3LYP	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1877.76970068; Eh
	3-May-2019	b3lyp-Ru-2-H2O-III-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UB3LYP	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1877.59152185; Eh
	3-May-2019	bp86-Ru-2-H2O-II-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	RBP86	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1877.87350192; Eh
	3-May-2019	bp86-Ru-2-H2O-III-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UBP86	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1877.69144733; Eh

Results 221-230 of 254 (Search time: 0.002 seconds).