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Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_9Li+_10e-_opt	Escayola Gordils, Sílvia	-	Single point Minimum	U-DFT	def2-mSVP	-2947.632545962; Eh
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_10Li+_9e-_opt	Escayola Gordils, Sílvia	-	Single point TS	U-DFT	def2-mSVP	-2955.015131576; Eh
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_3Li+_3e-_3Li2S_sp	Escayola Gordils, Sílvia	-	Single point	U-DFT	def2-TZVPD	-1711.577900954; Eh
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_Li+_e-_4Li2S_sp	Escayola Gordils, Sílvia	-	Single point	U-DFT	def2-TZVPD	-1298.088858486; Eh
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_10Li+_9e-_sp	Escayola Gordils, Sílvia	-	Single point	U-DFT	def2-TZVPD	-2959.258174506; Eh
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_9Li+_10e-_sp	Escayola Gordils, Sílvia	-	Single point	U-DFT	def2-TZVPD	-2951.854839248; Eh
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_2Li+_3e-_opt	Escayola Gordils, Sílvia	-	Single point Minimum	U-DFT	def2-mSVP	-2894.683438078; Eh
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_2Li+_e-_opt	Escayola Gordils, Sílvia	-	Single point Minimum	U-DFT	def2-mSVP	-2894.382463381; Eh
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_2Li+_2e-_opt	Escayola Gordils, Sílvia	-	Single point Minimum	U-DFT	def2-mSVP	-2894.563501889; Eh
6-Feb-2026	/SPVP_EXT_PAH2 SPVP_Li2S_opt	Escayola Gordils, Sílvia	-	Single point Minimum	U-DFT	def2-mSVP	-2481.625234500; Eh

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