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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	1-Dec-2021	TS256	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X; RCCSD	GEN AUG-CC-PVTZ	-362.9836138; Eh
	1-Dec-2021	TS81	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X; RCCSD	GEN AUG-CC-PVTZ	-363.0320451; Eh
	1-Dec-2021	TS128	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X; RCCSD	GEN AUG-CC-PVTZ	-362.993761; Eh
	1-Dec-2021	TS65	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	UM062X; UCCSD	GEN AUG-CC-PVTZ	-362.4119708; Eh
	1-Dec-2021	TS37	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X; RCCSD	GEN AUG-CC-PVTZ	-363.0533971; Eh
	1-Dec-2021	TS82	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	UM062X; UCCSD	GEN AUG-CC-PVTZ	-362.3728909; Eh
	1-Dec-2021	TS99	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X; RCCSD	GEN AUG-CC-PVTZ	-363.0087215; Eh
	1-Dec-2021	TS14	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RM062X; RCCSD	GEN AUG-CC-PVTZ	-363.0578445; Eh
	1-Dec-2021	TS735	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	UM062X; UCCSD	GEN AUG-CC-PVTZ	-362.292838; Eh
	1-Dec-2021	TS229	Garay Ruiz, Diego	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	UM062X; UCCSD	GEN AUG-CC-PVTZ	-362.3130307; Eh

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