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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_28_R_1_28_R_1_28_sp_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point	DFT	def2-QZVPP; def2-QZVPP/C; def2/J	-751.26891299; Eh
	28-Feb-2026	Si_29_P_1_29_F_P_1_29_F_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-906.88648955; Eh
	28-Feb-2026	Si_29_P_1_29_F_1_P_1_29_F_1_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-806.82753991; Eh
	28-Feb-2026	Si_29_P_1_29_F_P_1_29_F_opt_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Geometry optimization	DFT	-	-906.88649772; Eh
	28-Feb-2026	Si_29_P_1_29_F_1_P_1_29_F_1_opt_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Geometry optimization	DFT	-	-806.82757148; Eh
	28-Feb-2026	Si_28_R_1_28_R_1_28_hess_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point Minimum	DFT	-	-751.20129856; Eh
	28-Feb-2026	Si_28_R_1_28_R_1_28_opt_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Geometry optimization	DFT	-	-751.15618880; 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_30_P_1_30_O_P_1_30_O_sp_orca	Mulks, Florian; Barrera, Yoshio	Orca; 5.0.4; RELEASE	Single point	DFT	def2-QZVPP; def2-QZVPP/C; def2/J	-668.36559492; Eh

Results 383941-383950 of 397199 (Search time: 0.245 seconds).