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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-99-lig/9c-etjohnphos-99-lig-opt 9c-etjohnphos-99-lig-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-961.018977425; Eh
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-44-ts-t3-p1/9c-etjohnphos-44-ts-t3-p1-orcasp 9c-etjohnphos-44-ts-t3-p1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2583.90373011; Eh
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-45-p1-h2o/9c-etjohnphos-45-p1-h2o-orcasp 9c-etjohnphos-45-p1-h2o-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2583.95821788; Eh
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-43-t3-lig/9c-etjohnphos-43-t3-lig-orcasp 9c-etjohnphos-43-t3-lig-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2583.91760093; Eh
	26-Jan-2025	/9d-mejohnphos/9d-mejohnphos-00-lpdoh2/9d-mejohnphos-00-lpdoh2-orcasp 9d-mejohnphos-00-lpdoh2-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2321.41508121; Eh
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-99-lig/9c-etjohnphos-99-lig-orcasp 9c-etjohnphos-99-lig-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-960.22287740; Eh
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-40-ts-t2-p1/9c-etjohnphos-40-ts-t2-p1-opt 9c-etjohnphos-40-ts-t2-p1-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2762.30757669; Eh
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-41-p1-boh3/9c-etjohnphos-41-p1-boh3-opt 9c-etjohnphos-41-p1-boh3-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2762.38081773; Eh
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-39-t2-lig/9c-etjohnphos-39-t2-lig-opt 9c-etjohnphos-39-t2-lig-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2762.32157620; Eh
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-43-t3-lig/9c-etjohnphos-43-t3-lig-opt 9c-etjohnphos-43-t3-lig-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2586.56795575; Eh

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