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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required22-Aug-2018/ads_sn2_Co2_Cu2 fsLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--489.24242835; eV
Login required22-Aug-2018/slabs_opt slab_Co_OH2Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--428.27722956; eV
Login required22-Aug-2018/ads_Co_OH2 ch3ohLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--880.53390917; eV
Login required22-Aug-2018/xps/Co_Cu3 120Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--908.74005930; eV
Login required22-Aug-2018/xps/Cu111 4Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--509.55377449; eV
Login required22-Aug-2018/solvation/solvent nh3Li, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexGeometry optimizationDFT--19.53746114; eV
Login required22-Aug-2018/bulk_opt/magnetic_determination antiLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--110.61798702; eV
Login required22-Aug-2018/slabs_opt slab_Co_Cu2Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--531.05509024; eV
Login required22-Aug-2018/xps/Co_Cu3 131Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--908.54706528; eV
Login required22-Aug-2018/xps/Co_Cu3 136Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--908.58379761; eV
Results 31-40 of 403 (Search time: 0.001 seconds).