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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	8-Jun-2026	/Marcus_Theory/EnT Z_T	Funes, Ignacio; Sampedro, Diego; Sanosa, Nil	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	wB97xD	DEF2SVP	-540.070776517; Eh
	8-Jun-2026	/Marcus_Theory/EnT O2_S	Funes, Ignacio; Sampedro, Diego; Sanosa, Nil	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	wB97xD	DEF2SVP	-150.093388212; Eh
	8-Jun-2026	/Marcus_Theory/EnT O2_T	Funes, Ignacio; Sampedro, Diego; Sanosa, Nil	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	wB97xD	DEF2SVP	-150.155661721; Eh
	27-Jun-2024	2PrOH_SP	von Wolff, Niklas	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	RPBE1PBE	DEF2TZVP	-193.0014159; Eh
	27-Jun-2024	1PrOH_SP	von Wolff, Niklas	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	RPBE1PBE	DEF2TZVP	-194.2093305; Eh
	9-Jun-2026	/high-field_APCI ETN_radical-anion_C105	Haack, Alexander; Ieritano, Christian	Orca; 6.0.1; RELEASE	Geometry optimization Minimum	DFT	def2-TZVPP; def2/J	-1277.35831822470300; Eh
	9-Jun-2026	/high-field_APCI ETN_radical-anion_C66	Haack, Alexander; Ieritano, Christian	Orca; 6.0.1; RELEASE	Geometry optimization Minimum	DFT	def2-TZVPP; def2/J	-1277.35092383642905; Eh
	9-Jun-2026	/high-field_APCI ETN_radical-anion_C100	Haack, Alexander; Ieritano, Christian	Orca; 6.0.1; RELEASE	Geometry optimization Minimum	DFT	def2-TZVPP; def2/J	-1277.36641233834052; Eh
	9-Jun-2026	/high-field_APCI Acetone_protonate_dimer_C1	Haack, Alexander; Ieritano, Christian	Orca; 6.0.1; RELEASE	Geometry optimization	DFT	def2-TZVPP; def2/J	-386.73370505489117; Eh
	9-Jun-2026	/high-field_APCI HMTD_protonate_C1	Haack, Alexander; Ieritano, Christian	Orca; 6.0.1; RELEASE	Geometry optimization Minimum	DFT	def2-TZVPP; def2/J	-796.83467073435713; Eh

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