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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required20-Jun-2025/Mn_proj/Molecules/IO4_/phonopy/disp_005 disp_005Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--51.26682054; eV
Login required20-Jun-2025/Mn_proj/Molecules/IO4_/phonopy/disp_004 disp_004Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--51.26721436; eV
Login required20-Jun-2025/Mn_proj/Molecules/IO4_/phonopy/disp_003 disp_003Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--51.26565518; eV
Login required20-Jun-2025/Mn_proj/Molecules/IO4_/phonopy/disp_014 disp_014Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--51.26480428; eV
Login required20-Jun-2025/Mn_proj/Molecules/IO4_/phonopy/disp_013 disp_013Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--51.27320489; eV
Login required20-Jun-2025/Mn_proj/Molecules/IO4_/phonopy/disp_012 disp_012Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--51.26826026; eV
Login required20-Jun-2025/Mn_proj/Molecules/IO4_/phonopy/disp_028 disp_028Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--51.26201586; eV
Login required20-Jun-2025/Mn_proj/Molecules/IO4_/phonopy/disp_006 disp_006Benzidi, Hindvasp; 6.4.2; 20Jul23 (build Apr 19 2024 10:32:06) complexSingle pointDFT--51.26696644; eV
Login required19-Mar-2026/PMoW P01Mo03W06O31-2H-iso-25212Buils, JordiADF; 2019Geometry optimizationPBETZP-12.88597871; Eh
Login required19-Mar-2026/PMoW P01Mo00W03O13-3H-iso-0Buils, JordiADF; 2019Geometry optimizationPBETZP-5.44618142; Eh
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