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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-48-c-ref/3m-cyjohnphos-48-c-ref-opt 3m-cyjohnphos-48-c-ref-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-1551.85234484; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-47-oacu-ref/3m-cyjohnphos-47-oacu-ref-orcasp 3m-cyjohnphos-47-oacu-ref-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-3709.30845798; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-46-ub-ref/3m-cyjohnphos-46-ub-ref-orcasp 3m-cyjohnphos-46-ub-ref-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-3100.22385548; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-49-t-ref/3m-cyjohnphos-49-t-ref-orcasp 3m-cyjohnphos-49-t-ref-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1550.07922916; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-48-c-ref/3m-cyjohnphos-48-c-ref-orcasp 3m-cyjohnphos-48-c-ref-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1550.07678994; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-44-ts-t3-p1/3m-cyjohnphos-44-ts-t3-p1-opt 3m-cyjohnphos-44-ts-t3-p1-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-3209.52844443; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-45-p1-h2o/3m-cyjohnphos-45-p1-h2o-opt 3m-cyjohnphos-45-p1-h2o-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-3209.56969702; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-43-t3-lig/3m-cyjohnphos-43-t3-lig-opt 3m-cyjohnphos-43-t3-lig-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-3209.53962899; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-42-p1/3m-cyjohnphos-42-p1-opt 3m-cyjohnphos-42-p1-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-3133.27658411; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-44-ts-t3-p1/3m-cyjohnphos-44-ts-t3-p1-orcasp 3m-cyjohnphos-44-ts-t3-p1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-3206.00350956; Eh

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