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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/3w-tbuxphos/3w-tbuxphos-73-ts-t4ob-t5ob/3w-tbuxphos-73-ts-t4ob-t5ob-opt 3w-tbuxphos-73-ts-t4ob-t5ob-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2311.28642287; Eh
	5-May-2025	/3e-pcy3/3e-pcy3-6cn02-ts-rxt-c1/3e-pcy3-6cn02-ts-rxt-c1-opt 3e_pcy3_6cn02_ts_rxt_c1	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-1977.78252678; Eh
	5-May-2025	/3e-pcy3/3e-pcy3-6ome16-t2-h2o/3e-pcy3-6ome16-t2-h2o-opt 3e_pcy3_6ome16_t2_h2o	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2076.35614511; Eh
	26-Jan-2025	/3j-iprjohnphos/3j-iprjohnphos-33-ts-rxt-ya/3j-iprjohnphos-33-ts-rxt-ya-orcasp 3j-iprjohnphos-33-ts-rxt-ya-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1877.68349870; Eh
	5-May-2025	/3m-cyjohnphos/3m-cyjohnphos-6cne14-et1/3m-cyjohnphos-6cne14-et1-orcasp 3m_cyjohnphos_6cne14_et1	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2436.28897738; Eh
	5-May-2025	/base-reactants/base-reactants-6cnnaphbpin/base-reactants-6cnnaphbpin-orcasp base_reactants_6cnnaphbpin	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-886.18852016; Eh
	5-May-2025	/3m-cyjohnphos/3m-cyjohnphos-6cn01-rxt/3m-cyjohnphos-6cn01-rxt-orcasp 3m_cyjohnphos_6cn01_rxt	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2202.43377658; Eh
	26-Jan-2025	/3n-cymephos/3n-cymephos-18-t3-boh3/3n-cymephos-18-t3-boh3-orcasp 3n-cymephos-18-t3-boh3-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2225.88171724; Eh
	26-Jan-2025	/3s-brettphos/3s-brettphos-21-t4/3s-brettphos-21-t4-orcasp 3s-brettphos-21-t4-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2515.79959294; Eh
	5-May-2025	/3t-tbujohnphos/3t-tbujohnphos-6cne04-ts-ec1-ec2/3t-tbujohnphos-6cne04-ts-ec1-ec2-opt 3t_tbujohnphos_6cne04_ts_ec1_ec2	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2284.41893822; Eh

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