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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	18-May-2024	/electro-Sn/Fe3Mn2/S3-3I S3-3I-opt	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	UB3LYP	DEF2TZVP DEF2SVP GEN	-10483.4517210; Eh
	18-May-2024	/electro-Sn/Fe3Mn2/S2-3F S2-3F-opt	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	UB3LYP	DEF2TZVP DEF2SVP GEN	-10484.0479312; Eh
	18-May-2024	/electro-Sn/Fe3Mn2/S3-3H S3-3H-opt	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	UB3LYP	DEF2TZVP DEF2SVP GEN	-10483.4777905; Eh
	17-May-2024	/thermal/Fe3Mn2/aa2 aa2-opt	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	UB3LYP	DEF2TZVP DEF2SVP GEN	-10484.9542671; Eh
	17-May-2024	/thermal/Fe3Mn2/ac1 ac1-opt	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	UB3LYP	DEF2TZVP DEF2SVP GEN	-10484.9688804; Eh
	17-May-2024	/thermal/Fe3Mn2/cc1 cc1-opt	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	UB3LYP	DEF2TZVP DEF2SVP GEN	-10484.9474270; Eh
	17-May-2024	/thermal/Fe3Mn2/aa1 aa1-opt	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	UB3LYP	DEF2TZVP DEF2SVP GEN	-10484.9626809; Eh
	17-May-2024	/thermal/Fe3Mn2/ac2 ac2-opt	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	UB3LYP	DEF2TZVP DEF2SVP GEN	-10484.9524264; Eh
	8-Jan-2024	im2-trans-tz	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	UB3LYP	DEF2TZVP	-2468.5866853; Eh
	8-Jan-2024	im3-trans-tz	Phung, Quan	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	UB3LYP	DEF2TZVP	-2468.5908982; Eh

Results 41-50 of 111 (Search time: 0.002 seconds).