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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	13-Feb-2023	/homoconjugation CS-16	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE	DEF2TZVPP	-461.913913898; Eh
	13-Feb-2023	/homoconjugation CS-6	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE	DEF2TZVPP	-423.333385008; Eh
	13-Feb-2023	/neutral_H 20	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE	DEF2SVP	-654.270923761; Eh
	13-Feb-2023	/neutral_H 21	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE	DEF2SVP	-654.270634705; Eh
	13-Feb-2023	/base-driven_skeletal_rearrangements_/anion35 35_anion_C_b	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE	DEF2SVP	-1282.32334256; Eh
	13-Feb-2023	/base-driven_skeletal_rearrangements_/anion35 35_anion_D_a	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE	DEF2SVP	-1282.31040907; Eh
	13-Feb-2023	/base-driven_skeletal_rearrangements_/anion42 41_anion_b	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE	DEF2SVP	-1282.33780172; Eh
	13-Feb-2023	/base-driven_skeletal_rearrangements_/anion42 41_anion_a	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBE1PBE	DEF2SVP	-1282.33861037; Eh
	13-Feb-2023	/base-driven_skeletal_rearrangements_/anion42 42_anion_TS2_a	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBE1PBE	DEF2SVP	-1282.32243196; Eh
	13-Feb-2023	/base-driven_skeletal_rearrangements_/anion42 42_anion_TS1_b	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBE1PBE	DEF2SVP	-1282.29280591; Eh

Results 61-70 of 170 (Search time: 0.001 seconds).