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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-19-int7c/unlig-pdoh2-19-int7c-orcasp unlig-pdoh2-19-int7c-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1223.80926136; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-21-int8c/unlig-pdoh2-21-int8c-orcasp unlig-pdoh2-21-int8c-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1223.77404435; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-17-ts-int6c-int7c/unlig-pdoh2-17-ts-int6c-int7c-opt unlig-pdoh2-17-ts-int6c-int7c-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-1477.39621132; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-16-int6c-h2o/unlig-pdoh2-16-int6c-h2o-opt unlig-pdoh2-16-int6c-h2o-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-1477.41515836; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-18-int7c-boh3/unlig-pdoh2-18-int7c-boh3-opt unlig-pdoh2-18-int7c-boh3-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-1477.41593099; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-15-int6c/unlig-pdoh2-15-int6c-opt unlig-pdoh2-15-int6c-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-1401.10683600; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-19-int7c/unlig-pdoh2-19-int7c-opt unlig-pdoh2-19-int7c-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-1225.35923748; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-17-ts-int6c-int7c/unlig-pdoh2-17-ts-int6c-int7c-orcasp unlig-pdoh2-17-ts-int6c-int7c-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1475.71073644; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-16-int6c-h2o/unlig-pdoh2-16-int6c-h2o-orcasp unlig-pdoh2-16-int6c-h2o-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1475.73944146; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-18-int7c-boh3/unlig-pdoh2-18-int7c-boh3-orcasp unlig-pdoh2-18-int7c-boh3-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1475.73551540; Eh

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