Search        

Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg16-Jul-2024/M_Fe_N_din4_x2/M_Fe_N_din4_x2_c2_c/Co_Fe_N_din4_x2_c2_c dosMinotaki, Mariavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--632.58628937; eV
thumbnail.jpeg16-Jul-2024/M_Fe_N_din4_x2/M_Fe_N_din4_x2_c4_f/Ni_Fe_N_din4_x2_c4_f dosMinotaki, Mariavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--612.14028583; eV
Login required2-Jul-2025/recons/Cu_recon Cu_reconBenzidi, Hindvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--103.41329688; eV
Login required2-Jul-2025/surf/slab_100/corr/OCCO OCCOBenzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--481.32161232; eV
Login required2-Jul-2025/surf/slab_100/corr/H HBenzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--514.56405949; eV
Login required2-Jul-2025/recons/v_o4/test testBenzidi, Hindvasp; 6.4.2; 20Jul23 (build Jun 12 2024 12:22:38) complexSingle pointDFT--1777.25850785; eV
Login required2-Jul-2025/recons/v_o4 v_o4Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Jun 12 2024 12:22:38) complexSingle pointDFT--1736.45100251; eV
Login required2-Jul-2025/surf/slab_011 slab_011Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--505.33882060; eV
Login required2-Jul-2025/surf/slab_001 slab_001Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--511.76036574; eV
Login required2-Jul-2025/recons reconsBenzidi, Hindvasp; 6.4.2; 20Jul23 (build Jun 12 2024 12:22:38) complexSingle pointDFT--1719.74354653; eV
Results 2961-2970 of 100263 (Search time: 0.004 seconds).