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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	19-Mar-2026	/AsTaW As01Ta05W06O39-0H-iso-23975778	Buils, Jordi	ADF; 2019; 304	Geometry optimization	PBE	TZP	-17.28748840; Eh
	19-Mar-2026	/AsTaW As01Ta05W04O31-3H-iso-1440	Buils, Jordi	ADF; 2019; 304	Geometry optimization	PBE	TZP	-13.83293655; Eh
	19-Mar-2026	/AsTaW As01Ta04W05O34-0H-iso-204556	Buils, Jordi	ADF; 2019; 304	Geometry optimization	PBE	TZP	-14.93535045; Eh
	19-Mar-2026	/AsTaW As01Ta05W04O31-0H-iso-163873	Buils, Jordi	ADF; 2019; 304	Geometry optimization	PBE	TZP	-13.73464748; Eh
	19-Mar-2026	/AsTaW As01Ta04W05O31-0H-iso-204961	Buils, Jordi	ADF; 2019; 304	Geometry optimization	PBE	TZP	-13.60400065; Eh
	19-Mar-2026	/AsTaW As01Ta02W09O39-0H-iso-484	Buils, Jordi	ADF; 2019; 304	Geometry optimization	PBE	TZP	-16.96946560; Eh
	8-Sep-2026	/substrate-assisted pathway INT8-b	Wang, Yingying; Bo, Carles; Hugo, Salazar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	wb97xd	6-311G(D,P)	-1320.01221555; Eh
	8-Sep-2026	/Two-TBD INT6-a	Wang, Yingying; Bo, Carles; Hugo, Salazar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	wb97xd	6-311G(D,P)	-1758.84428094; Eh
	8-Sep-2026	/Two-TBD INT4a	Wang, Yingying; Bo, Carles; Hugo, Salazar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	wb97xd	6-311G(D,P)	-1758.85310688; Eh
	8-Sep-2026	/Two-TBD INT7-a	Wang, Yingying; Bo, Carles; Hugo, Salazar	Gaussian; 16; AM64L-G16RevA.03	Geometry optimization Minimum	wb97xd	6-311G(D,P)	-1758.83919752; Eh

Results 104261-104270 of 104297 (Search time: 0.067 seconds).