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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/3e-pcy3/3e-pcy3-86-c2-naphboh2/3e-pcy3-86-c2-naphboh2-orcasp 3e-pcy3-86-c2-naphboh2-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2444.00745672; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-24-t5/3y-me4tbuxphos-24-t5-orcasp 3y-me4tbuxphos-24-t5-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2541.55337753; Eh
	26-Jan-2025	/3a-pph3/3a-pph3-18-t3-boh3/3a-pph3-18-t3-boh3-orcasp 3a-pph3-18-t3-boh3-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1949.25450188; Eh
	26-Jan-2025	/3r-xphos/3r-xphos-08-c3-boh3/3r-xphos-08-c3-boh3-orcasp 3r-xphos-08-c3-boh3-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2539.30729020; Eh
	26-Jan-2025	/3k-phjohnphos/3k-phjohnphos-17-ts-t2-t3/3k-phjohnphos-17-ts-t2-t3-opt 3k-phjohnphos-17-ts-t2-t3-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2181.84694489; Eh
	26-Jan-2025	/3q-ruphos/3q-ruphos-25-ts-t5-t6/3q-ruphos-25-ts-t5-t6-opt 3q-ruphos-25-ts-t5-t6-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2574.62704711; Eh
	5-May-2025	/3h-ptbu3/3h-ptbu3-6cn05-c2/3h-ptbu3-6cn05-c2-opt 3h_ptbu3_6cn05_c2	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-1745.98206488; Eh
	26-Jan-2025	/3e-pcy3/3e-pcy3-87-ts-c2-naphboh2-hc1/3e-pcy3-87-ts-c2-naphboh2-hc1-orcasp 3e-pcy3-87-ts-c2-naphboh2-hc1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2443.99694434; Eh
	26-Jan-2025	/9a-cbujohnphos/9a-cbujohnphos-44-ts-t3-p1/9a-cbujohnphos-44-ts-t3-p1-orcasp 9a-cbujohnphos-44-ts-t3-p1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point; Single point	-	def2-QZVPP; def2-QZVPP/C	-2892.44075819; -2892.44077112; Eh; Eh
	5-May-2025	/3m-cyjohnphos/3m-cyjohnphos-6omee18-ts-et2-et3/3m-cyjohnphos-6omee18-ts-et2-et3-orcasp 3m_cyjohnphos_6omee18_ts_et2_et3	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2534.76573696; Eh

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