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Browsing by Author Vidal, Daniel

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Showing results 21 to 40 of 294 < previous next >

Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy
2-Jan-2023	/L2_META S2_L2_META_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2739.28060398; Eh
2-Jan-2023	/L2_META S2_L2_META_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2739.28885348; Eh
2-Jan-2023	/L2_META S3_L2_META_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-3332.08698160; Eh
2-Jan-2023	/L2_META S3_L2_META_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-3332.09615171; Eh
2-Jan-2023	/L2_META S4_L2_META_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2888.94073687; Eh
2-Jan-2023	/L2_META S4_L2_META_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2888.94832630; Eh
2-Jan-2023	/L2_META S5_L2_META_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2858.79650057; Eh
2-Jan-2023	/L2_META S5_L2_META_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2858.80539006; Eh
2-Jan-2023	/L2_META S6_L2_META_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-3577.73503457; Eh
2-Jan-2023	/L2_META S6_L2_META_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-3577.74384553; Eh
2-Jan-2023	/L2_META S7_L2_META_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-7799.44370945; Eh
2-Jan-2023	/L2_META S7_L2_META_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-7799.45252590; Eh
2-Jan-2023	/L2_META S8_L2_META_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2771.28316470; Eh
2-Jan-2023	/L2_META S8_L2_META_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2771.29087166; Eh
2-Jan-2023	/L2_META S9_L2_META_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2844.60734604; Eh
2-Jan-2023	/L2_META S9_L2_META_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2844.61652581; Eh
2-Jan-2023	/L2_PARA S1_L2_PARA_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2661.20234950; Eh
2-Jan-2023	/L2_PARA S1_L2_PARA_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2661.21052329; Eh
2-Jan-2023	/L2_PARA S2_L2_PARA_HS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2739.27682347; Eh
2-Jan-2023	/L2_PARA S2_L2_PARA_LS_FREQ	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UBLYP	DEF2TZVP	-2739.28480575; Eh

Showing results 21 to 40 of 294 < previous next >