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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-pdoh2-20-ts-int7c-int8c/unlig-pdoh2-20-ts-int7c-int8c-orcasp unlig-pdoh2-20-ts-int7c-int8c-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1223.75317164; Eh
	26-Jan-2025	/unlig-pdoh2/unlig-pdoh2-02-ts-rxt-int1/unlig-pdoh2-02-ts-rxt-int1-orcasp unlig-pdoh2-02-ts-rxt-int1-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1399.38893158; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6cne16-et2/3t-tbujohnphos-6cne16-et2-orcasp 3t_tbujohnphos_6cne16_et2	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2281.92251784; Eh
	26-Jan-2025	/3v-tbudavephos/3v-tbudavephos-19-t3/3v-tbudavephos-19-t3-orcasp 3v-tbudavephos-19-t3-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1913.91775655; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-20-ts-t3-t4/3y-me4tbuxphos-20-ts-t3-t4-opt 3y-me4tbuxphos-20-ts-t3-t4-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2292.42819858; Eh
	26-Jan-2025	/3b-potol3/3b-potol3-23-ts-c5-c6/3b-potol3-23-ts-c5-c6-opt 3b-potol3-23-ts-c5-c6-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2068.93346002; Eh
	5-May-2025	/3m-cyjohnphos/3m-cyjohnphos-6omee14-et1/3m-cyjohnphos-6omee14-et1-opt 3m_cyjohnphos_6omee14_et1	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2461.25779680; Eh
	26-Jan-2025	/3v-tbudavephos/3v-tbudavephos-03-c1/3v-tbudavephos-03-c1-opt 3v-tbudavephos-03-c1-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2091.86636445; Eh
	26-Jan-2025	/3l-phdavephos/3l-phdavephos-01-rxt/3l-phdavephos-01-rxt-opt 3l-phdavephos-01-rxt-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2239.26227301; Eh
	5-May-2025	/3e-pcy3/3e-pcy3-6omee13-ts-etrxt-et1/3e-pcy3-6omee13-ts-etrxt-et1-orcasp 3e_pcy3_6omee13_ts_etrxt_et1	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2231.73107056; Eh

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