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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	20-Jun-2025	/Mn_proj/Molecules/IO4_/phonopy/disp_007 disp_007	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-51.26538940; eV
	20-Jun-2025	/Mn_proj/Molecules/IO4_/phonopy/disp_011 disp_011	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-51.27051646; eV
	20-Jun-2025	/Mn_proj/Molecules/IO4_/phonopy/disp_022 disp_022	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-51.27331428; eV
	20-Jun-2025	/Mn_proj/Molecules/NO2 NO2	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Jun 12 2024 14:44:05) gamma-only	Single point	DFT	-	-8.18490391; eV
	2-Feb-2026	/Interfaces-MLIP/DFT-single-points/r-TiO₂-M/r-TiO₂-Ni r-TiO₂-Ni-15vac	Morales-Vidal, Jordi	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Single point	DFT	-	-876.18313836; eV
	20-Jun-2025	/Mn_proj/Molecules/BrO3−/phonopy/disp_019 disp_019	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-336.68390473; eV
	20-Jun-2025	/Mn_proj/Molecules/BrO3−/phonopy/disp_018 disp_018	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-336.68714083; eV
	20-Jun-2025	/Mn_proj/Molecules/BrO3−/phonopy/disp_026 disp_026	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-336.68591254; eV
	20-Jun-2025	/Mn_proj/Molecules/BrO3−/phonopy/disp_030 disp_030	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-336.68684427; eV
	20-Jun-2025	/Mn_proj/Molecules/BrO3−/phonopy/disp_017 disp_017	Benzidi, Hind	vasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complex	Single point	DFT	-	-336.68533167; eV

Results 98661-98670 of 103542 (Search time: 0.057 seconds).