Search        

Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required2-Jul-2025/Bulk_structure/H2O/phonopy/disp_014 disp_014Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--14.42751331; eV
Login required2-Jul-2025/Bulk_structure/H2O/phonopy/disp_013 disp_013Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--14.42664128; eV
Login required2-Jul-2025/Bulk_structure/H2O/phonopy/disp_012 disp_012Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--14.42955788; eV
Login required2-Jul-2025/Bulk_structure/H2O/phonopy/disp_011 disp_011Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--14.42957135; eV
Login required2-Jul-2025/Bulk_structure/H2O/phonopy/disp_009 disp_009Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--14.42782442; eV
Login required2-Jul-2025/Bulk_structure/H2O/phonopy/disp_008 disp_008Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--14.42839328; eV
thumbnail.jpeg26-Feb-2025/single_point_recalculations_Eel/T25 Mo05O22-8HJunkers, Laura S.ADF; 2019Single pointPBETZP-
thumbnail.jpeg26-Feb-2025/single_point_recalculations_Eel/T25 Mo05O22-6HJunkers, Laura S.ADF; 2019Single pointPBETZP-
thumbnail.jpeg26-Feb-2025/single_point_recalculations_Eel/T25 Mo05O22-7HJunkers, Laura S.ADF; 2019Single pointPBETZP-
thumbnail.jpeg26-Feb-2025/single_point_recalculations_Eel/T25 Mo06O20-2HJunkers, Laura S.ADF; 2019Single pointPBETZP-
Results 4561-4570 of 101953 (Search time: 0.006 seconds).