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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/3z-adjohnphos/3z-adjohnphos-03-c1/3z-adjohnphos-03-c1-orcasp 3z-adjohnphos-03-c1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2419.08015569; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-83-ts-t2-t3-6mps/3y-me4tbuxphos-83-ts-t2-t3-6mps-opt 3y-me4tbuxphos-83-ts-t2-t3-6mps-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2620.78031408; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-84-t3-boh3h2o/3y-me4tbuxphos-84-t3-boh3h2o-opt 3y-me4tbuxphos-84-t3-boh3h2o	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2620.79824432; Eh
	26-Jan-2025	/3z-adjohnphos/3z-adjohnphos-00-lpdoh2/3z-adjohnphos-00-lpdoh2-opt 3z-adjohnphos-00-lpdoh2-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-3721.99316067; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-99-lig/3y-me4tbuxphos-99-lig-opt 3y-me4tbuxphos-99-lig-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-1627.95631123; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-83-ts-t2-t3-6mps/3y-me4tbuxphos-83-ts-t2-t3-6mps-orcasp 3y-me4tbuxphos-83-ts-t2-t3-6mps-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-TZVPP/C	-2617.76809182; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-82-ts-t2-t3-4mps/3y-me4tbuxphos-82-ts-t2-t3-4mps-orcasp 3y-me4tbuxphos-82-ts-t2-t3-4mps-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-TZVPP/C	-2541.50778988; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-84-t3-boh3h2o/3y-me4tbuxphos-84-t3-boh3h2o-orcasp 3y-me4tbuxphos-84-t3-boh3h2o	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2617.82363469; Eh
	26-Jan-2025	/3z-adjohnphos/3z-adjohnphos-00-lpdoh2/3z-adjohnphos-00-lpdoh2-orcasp 3z-adjohnphos-00-lpdoh2-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-3717.60837319; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-99-lig/3y-me4tbuxphos-99-lig-orcasp 3y-me4tbuxphos-99-lig-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1626.19366490; Eh

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