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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	5-May-2025	/base-reactants/base-reactants-6cnnaphboh2/base-reactants-6cnnaphboh2-orcasp base_reactants_6cnnaphboh2	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-652.31543551; Eh
	26-Jan-2025	/3q-ruphos/3q-ruphos-18-t3-boh3/3q-ruphos-18-t3-boh3-orcasp 3q-ruphos-18-t3-boh3-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2571.88210270; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-11-c4/3t-tbujohnphos-11-c4-orcasp 3t-tbujohnphos-11-c4-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1780.35386140; Eh
	26-Jan-2025	/3p-sphos/3p-sphos-11-c4/3p-sphos-11-c4-orcasp 3p-sphos-11-c4-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2163.19572731; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-45-p1-h2o/3t-tbujohnphos-45-p1-h2o-opt 3t-tbujohnphos-45-p1-h2o-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2900.40638011; Eh
	26-Jan-2025	/3d-pcpt3/3d-pcpt3-40-ts-t2-p1/3d-pcpt3-40-ts-t2-p1-opt 3d-pcpt3-40-ts-t2-p1-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2695.79282013; Eh
	26-Jan-2025	/3r-xphos/3r-xphos-17-ts-t2-t3/3r-xphos-17-ts-t2-t3-opt 3r-xphos-17-ts-t2-t3-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2542.14711029; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-04-ts-c1-c2/3y-me4tbuxphos-04-ts-c1-c2-orcasp 3y-me4tbuxphos-04-ts-c1-c2-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2465.26275855; Eh
	26-Jan-2025	/3aa-adbrettphos/3aa-adbrettphos-38-ts-yb-c1/3aa-adbrettphos-38-ts-yb-c1-orcasp 3aa-adbrettphos-38-ts-yb-c1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-TZVPP/C	-3076.35549037; Eh
	26-Jan-2025	/3f-pcy2tbu/3f-pcy2tbu-07-ts-c2-c3/3f-pcy2tbu-07-ts-c2-c3-orcasp 3f-pcy2tbu-07-ts-c2-c3-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1882.75711178; Eh

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