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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Feb-2026	C_11_P_1_11_O_P_1_11_O_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-681.24412085; Eh
	26-Feb-2026	RUFO-TS1	Kirk, Alicia	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	-	DUMMY	-4483.57346859; Eh
	28-Feb-2026	C_12_P_1_12_F_P_1_12_F_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-349.03685186; Eh
	28-Feb-2026	C_14_P_1_14_F_1_P_1_14_F_1_opt_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Geometry optimization	DFT	-	-327.58020111; Eh
	28-Feb-2026	C_11_P_1_11_F_P_1_11_F_opt_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Geometry optimization	DFT	-	-805.50900924; Eh
	26-Feb-2026	RUFO-R	Kirk, Alicia	Gaussian; 16; ES64L-G16RevC.02	Single point Structure	-	DUMMY	-4483.58115807; Eh
	28-Feb-2026	C_16_P_1_16_F_P_1_16_F_sp_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point	DFT	def2-QZVPP; def2-QZVPP/C; def2/J	-505.71337968; Eh
	28-Feb-2026	C_16_P_1_16_O_P_1_16_O_sp_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point	DFT	def2-QZVPP; def2-QZVPP/C; def2/J	-381.42387148; Eh
	28-Feb-2026	C_16_R_1_16_R_1_16_sp_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point	DFT	def2-QZVPP; def2-QZVPP/C; def2/J	-305.62823771; Eh
	28-Feb-2026	C_17_P_1_17_F_1_P_1_17_F_1_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-562.99223752; Eh

Results 382341-382350 of 397899 (Search time: 0.215 seconds).