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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	27-Sep-2021	SCO_M06L_S5_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UM06L	DEF2TZVP	-2708.79600453; Eh
	27-Sep-2021	SCO_M06L_S6_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Minimum	UM06L	DEF2TZVP	-3113.88911759; Eh
	27-Sep-2021	SCO_M06L_S3_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UM06L	DEF2TZVP	-2866.15647372; Eh
	27-Sep-2021	SCO_M06L_S4_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UM06L	DEF2TZVP	-2718.89914591; Eh
	27-Sep-2021	SCO_M06L_S4_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Minimum	UM06L	DEF2TZVP	-2718.88790799; Eh
	27-Sep-2021	SCO_M06L_S3_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UM06L	DEF2TZVP	-2866.14747866; Eh
	27-Sep-2021	SCO_M06L_S5_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Minimum	UM06L	DEF2TZVP	-2708.78406746; Eh
	27-Sep-2021	SCO_TPSSh_S12_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-4077.69180373; Eh
	27-Sep-2021	SCO_TPSSh_S11_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-8013.44778321; Eh
	27-Sep-2021	SCO_TPSSh_S11_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Minimum	UTPSSh	DEF2TZVP	-8013.42650283; Eh

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