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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-00-lpdoh2/3y-me4tbuxphos-00-lpdoh2-opt 3y-me4tbuxphos-00-lpdoh2-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-3814.67056538; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-01-rxt/3y-me4tbuxphos-01-rxt-opt 3y-me4tbuxphos-01-rxt-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2468.19100753; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-99-lig/3x-tbubrettphos-99-lig-opt 3x-tbubrettphos-99-lig-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-1699.66178566; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-84-t3-boh3h2o/3x-tbubrettphos-84-t3-boh3h2o-orcasp 3x-tbubrettphos-84-t3-boh3h2o	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2689.58823500; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-00-lpdoh2/3y-me4tbuxphos-00-lpdoh2-orcasp 3y-me4tbuxphos-00-lpdoh2-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-3809.97542480; Eh
	26-Jan-2025	/3y-me4tbuxphos/3y-me4tbuxphos-01-rxt/3y-me4tbuxphos-01-rxt-orcasp 3y-me4tbuxphos-01-rxt-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2465.29752169; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-99-lig/3x-tbubrettphos-99-lig-orcasp 3x-tbubrettphos-99-lig-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1697.94931175; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-80-ts-t5ob-t6ob-6mps/3x-tbubrettphos-80-ts-t5ob-t6ob-6mps-opt 3x-tbubrettphos-80-ts-t5ob-t6ob-6mps-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2307.35927605; 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	/3x-tbubrettphos/3x-tbubrettphos-83-ts-t2-t3-6mps/3x-tbubrettphos-83-ts-t2-t3-6mps-opt 3x-tbubrettphos-83-ts-t2-t3-6mps-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2692.49164320; Eh

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