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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/9b-cptjohnphos/9b-cptjohnphos-13-t1/9b-cptjohnphos-13-t1-opt 9b-cptjohnphos-13-t1-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2034.26466556; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-28-xa/3x-tbubrettphos-28-xa-orcasp 3x-tbubrettphos-28-xa-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2285.14532136; Eh
	5-May-2025	/3h-ptbu3/3h-ptbu3-6cne18-ts-et2-et3/3h-ptbu3-6cne18-ts-et2-et3-opt 3h_ptbu3_6cne18_ts_et2_et3	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2056.42646802; Eh
	5-May-2025	/3e-pcy3/3e-pcy3-6cne17-et2-h2o/3e-pcy3-6cne17-et2-h2o-opt 3e_pcy3_6cne17_et2_h2o	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2288.30624434; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-69-t4-boh3/3x-tbubrettphos-69-t4-boh3-opt 3x-tbubrettphos-69-t4-boh3-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2616.23612512; Eh
	26-Jan-2025	/3aa-adbrettphos/3aa-adbrettphos-99-lig/3aa-adbrettphos-99-lig-opt 3aa-adbrettphos-99-lig-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2163.33687920; Eh
	26-Jan-2025	/9d-mejohnphos/9d-mejohnphos-20-ts-t3-t4/9d-mejohnphos-20-ts-t3-t4-orcasp 9d-mejohnphos-20-ts-t3-t4-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1545.31802574; 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	/3g-ptbu2cy/3g-ptbu2cy-06-c2-h2o/3g-ptbu2cy-06-c2-h2o-orcasp 3g-ptbu2cy-06-c2-h2o-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1805.57559252; Eh
	26-Jan-2025	/3m-cyjohnphos/3m-cyjohnphos-39-t2-lig/3m-cyjohnphos-39-t2-lig-orcasp 3m-cyjohnphos-39-t2-lig-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-3381.70120711; Eh

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