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Item hits:

Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Orb.
6-Mar-2026	aldol_neutral_initial_TS182_0	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.261365663343; Eh	-	-
6-Mar-2026	aldol_neutral_initial_TS170_0	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.265469732869; Eh	-	-
6-Mar-2026	aldol_neutral_initial_TS193_0	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.264441989363; Eh	-	-
6-Mar-2026	aldol_neutral_initial_TS189_0	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.263626591204; Eh	-	-
6-Mar-2026	aldol_neutral_initial_TS190_0	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.261549758480; Eh	-	-
6-Mar-2026	aldol_neutral_initial_TS191_0	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.264438543209; Eh	-	-
6-Mar-2026	/fluronapthalene/sp/5F_isomer_57 5F_isomer_57	Charapale, Omkar	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	RMN15	CBSB3* 6-311G(2DF,2P)*	-881.5051153; Eh
6-Mar-2026	aldol_neutral_second_TS26	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.264881430511; Eh	-	-
6-Mar-2026	aldol_neutral_second_TS27	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.267414678026; Eh	-	-
6-Mar-2026	aldol_neutral_second_TS25	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.264330257846; Eh	-	-

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