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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Aug-2018/ads_sn2_Cu111 ch3ohLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--254.27115700; eV
thumbnail.jpeg22-Aug-2018/ads_sn2_Cu111 bh3nh3Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--261.30172611; eV
thumbnail.jpeg22-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
thumbnail.jpeg22-Aug-2018/ads_sn2_Co_Cu3 ch3ohLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--653.70856852; eV
thumbnail.jpeg22-Aug-2018/ads_sn2_Co_Cu3 isLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--673.09345274; eV
thumbnail.jpeg22-Aug-2018/ads_sn2_Co_Cu3 sn2Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--672.14012102; eV
thumbnail.jpeg22-Aug-2018/ads_sn2_Co_Cu3 slabLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--623.08327378; eV
thumbnail.jpeg22-Aug-2018/ads_sn2_Co2_Cu2 ch3ohLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--469.13083049; eV
thumbnail.jpeg22-Aug-2018/ads_sn2_Co2_Cu2 isLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--489.06121599; eV
thumbnail.jpeg22-Aug-2018/ads_sn2_Co_Cu2 isLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--580.98453164; eV
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