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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/3j-iprjohnphos/3j-iprjohnphos-03-c1/3j-iprjohnphos-03-c1-orcasp 3j-iprjohnphos-03-c1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1877.69043654; Eh
	26-Jan-2025	/3w-tbuxphos/3w-tbuxphos-24-t5/3w-tbuxphos-24-t5-orcasp 3w-tbuxphos-24-t5-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2384.89055741; Eh
	26-Jan-2025	/3e-pcy3/3e-pcy3-21-t4/3e-pcy3-21-t4-orcasp 3e-pcy3-21-t4-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1707.99889848; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-82-ts-t2-t3-4mps/3x-tbubrettphos-82-ts-t2-t3-4mps-opt 3x-tbubrettphos-82-ts-t2-t3-4mps-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2616.17828982; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-67-t4ob-h2o/3y-me4tbuxphos-67-t4ob-h2o-opt 3y-me4tbuxphos-67-t4ob-h2o-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2544.52613749; Eh
	26-Jan-2025	/3k-phjohnphos/3k-phjohnphos-12-ts-rxt-t1/3k-phjohnphos-12-ts-rxt-t1-orcasp 3k-phjohnphos-12-ts-rxt-t1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2103.29094342; Eh
	5-May-2025	/3e-pcy3/3e-pcy3-6omee19-et3-bpinoh/3e-pcy3-6omee19-et3-bpinoh-orcasp 3e_pcy3_6omee19_et3_bpinoh	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2308.01828293; Eh
	26-Jan-2025	/3g-ptbu2cy/3g-ptbu2cy-12-ts-rxt-t1/3g-ptbu2cy-12-ts-rxt-t1-orcasp 3g-ptbu2cy-12-ts-rxt-t1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1729.25452828; Eh
	26-Jan-2025	/3s-brettphos/3s-brettphos-23-ts-c5-c6/3s-brettphos-23-ts-c5-c6-orcasp 3s-brettphos-23-ts-c5-c6-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2767.68297482; Eh
	5-May-2025	/3h-ptbu3/3h-ptbu3-6omee14-et1/3h-ptbu3-6omee14-et1-orcasp 3h_ptbu3_6omee14_et1	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2000.16634904; Eh

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