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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Feb-2026	Si_26_P_1_26_F_P_1_26_F_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-1522.49723362; Eh
	28-Feb-2026	Si_26_P_1_26_F_1_P_1_26_F_1_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-1422.48681115; Eh
	28-Feb-2026	Si_26_P_1_26_F_1_P_1_26_F_1_opt_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Geometry optimization	DFT	-	-1422.48679736; Eh
	28-Feb-2026	Si_25_P_1_25_O_P_1_25_O_opt_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Geometry optimization	DFT	-	-1167.57946802; Eh
	28-Feb-2026	Si_25_R_1_25_R_1_25_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-1091.78254741; Eh
	28-Feb-2026	Si_25_R_1_25_R_1_25_opt_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Geometry optimization	DFT	-	-1091.78253029; Eh
	28-Feb-2026	Si_30_P_1_30_F_1_P_1_30_F_1_sp_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point	DFT	def2-QZVPP; def2-QZVPP/C; def2/J	-692.75769698; Eh
	28-Feb-2026	Si_30_P_1_30_F_P_1_30_F_sp_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point	DFT	def2-QZVPP; def2-QZVPP/C; def2/J	-792.80521878; Eh
	28-Feb-2026	Si_2_R_1_2_R_1_2_sp_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point	DFT	def2-QZVPP; def2-QZVPP/C; def2/J	-328.71324851; Eh
	28-Feb-2026	Si_30_P_1_30_F_P_1_30_F_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-792.82040542; Eh

Results 389841-389850 of 402373 (Search time: 0.246 seconds).