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Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Orb.
6-Mar-2026	Hydroamination_S_initial_TS24_1	Matsutani, Satoshi	GRRM; 23	SADDLE	B3LYP	def2svp:pm7)	-5372.818961363187; Eh	-	-
6-Mar-2026	Hydroamination_S_initial_TS60_0	Matsutani, Satoshi	GRRM; 23	SADDLE	B3LYP	def2svp:pm7)	-5372.797601117451; Eh	-	-
6-Mar-2026	Hydroamination_S_initial_TS74_0	Matsutani, Satoshi	GRRM; 23	SADDLE	B3LYP	def2svp:pm7)	-5372.815598482003; Eh	-	-
6-Mar-2026	Hydroamination_S_initial_TS40_0	Matsutani, Satoshi	GRRM; 23	SADDLE	B3LYP	def2svp:pm7)	-5372.831143775111; Eh	-	-
6-Mar-2026	Hydroamination_S_initial_TS97_0	Matsutani, Satoshi	GRRM; 23	SADDLE	B3LYP	def2svp:pm7)	-5372.816906273317; Eh	-	-
6-Mar-2026	Hydroamination_S_initial_TS64_0	Matsutani, Satoshi	GRRM; 23	SADDLE	B3LYP	def2svp:pm7)	-5372.822279664979; Eh	-	-
6-Mar-2026	Hydroamination_S_initial_TS5_0	Matsutani, Satoshi	GRRM; 23	SADDLE	B3LYP	def2svp:pm7)	-5372.813741472085; Eh	-	-
6-Mar-2026	Hydroamination_S_initial_TS1_0	Matsutani, Satoshi	GRRM; 23	SADDLE	B3LYP	def2svp:pm7)	-5372.813745363797; Eh	-	-
6-Mar-2026	/clnanographene/c24h12/sp/Cl1_c24h12 Cl1_c24h12	Charapale, Omkar	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	RMN15	CBSB3* 6-311G(2DF,2P)*	-1381.2238301; Eh
6-Mar-2026	/clnanographene/c6h6/sp/test/Cl2_c6h6 Cl2_c6h6	Charapale, Omkar	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	RMN15	CBSB3* 6-311G(2DF,2P)*	-692.2188275; Eh

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