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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-41-p1-boh3/3t-tbujohnphos-41-p1-boh3-orcasp 3t-tbujohnphos-41-p1-boh3-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-3072.93687019; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-43-t3-lig/3t-tbujohnphos-43-t3-lig-orcasp 3t-tbujohnphos-43-t3-lig-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2897.27114095; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-42-p1/3t-tbujohnphos-42-p1-orcasp 3t-tbujohnphos-42-p1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2820.99806912; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-25-ts-t5-t6/3t-tbujohnphos-25-ts-t5-t6-opt 3t-tbujohnphos-25-ts-t5-t6-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2034.46625867; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-23-ts-c5-c6/3t-tbujohnphos-23-ts-c5-c6-opt 3t-tbujohnphos-23-ts-c5-c6-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2034.46172833; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-39-t2-lig/3t-tbujohnphos-39-t2-lig-opt 3t-tbujohnphos-39-t2-lig-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-3076.13711635; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-24-t5/3t-tbujohnphos-24-t5-opt 3t-tbujohnphos-24-t5-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2034.47525680; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-25-ts-t5-t6/3t-tbujohnphos-25-ts-t5-t6-orcasp 3t-tbujohnphos-25-ts-t5-t6-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2032.26555348; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-23-ts-c5-c6/3t-tbujohnphos-23-ts-c5-c6-orcasp 3t-tbujohnphos-23-ts-c5-c6-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2032.25555993; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-39-t2-lig/3t-tbujohnphos-39-t2-lig-orcasp 3t-tbujohnphos-39-t2-lig-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-3072.93427758; Eh

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