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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6ome06-c2-h2o/3t-tbujohnphos-6ome06-c2-h2o-opt 3t_tbujohnphos_6ome06_c2_h2o	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2148.83158828; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6ome05-c2/3t-tbujohnphos-6ome05-c2-opt 3t_tbujohnphos_6ome05_c2	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2072.52762403; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6ome03-c1/3t-tbujohnphos-6ome03-c1-opt 3t_tbujohnphos_6ome03_c1	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2072.47646201; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6ome02-ts-rxt-c1/3t-tbujohnphos-6ome02-ts-rxt-c1-orcasp 3t_tbujohnphos_6ome02_ts_rxt_c1	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2070.24363988; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6ome04-ts-c1-c2/3t-tbujohnphos-6ome04-ts-c1-c2-orcasp 3t_tbujohnphos_6ome04_ts_c1_c2	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2070.23471356; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6ome06-c2-h2o/3t-tbujohnphos-6ome06-c2-h2o-orcasp 3t_tbujohnphos_6ome06_c2_h2o	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2146.56393418; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6ome03-c1/3t-tbujohnphos-6ome03-c1-orcasp 3t_tbujohnphos_6ome03_c1	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2070.23817943; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6ome05-c2/3t-tbujohnphos-6ome05-c2-orcasp 3t_tbujohnphos_6ome05_c2	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2070.30460037; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6cne18-ts-et2-et3/3t-tbujohnphos-6cne18-ts-et2-et3-opt 3t_tbujohnphos_6cne18_ts_et2_et3	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2360.73781109; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6ome02-ts-rxt-c1/3t-tbujohnphos-6ome02-ts-rxt-c1-opt 3t_tbujohnphos_6ome02_ts_rxt_c1	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2072.46631022; Eh

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