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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeg/bulk_opt/magnetic_determination antiLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--110.61798702; eV
thumbnail.jpeg/bulk_opt/magnetic_determination ferroLi, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--110.58245675; eV
thumbnail.jpeg/bulk_opt bulk_CuLi, Qiangvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexDFT--14.91368354; eV
thumbnail.jpeg/bulk_opt co_oh_2Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--106.68554452; eV
thumbnail.jpeg/gas_opt bh3nh3_gasLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexDFT--36.91970268; eV
thumbnail.jpeg/gas_opt ch3oh_gasLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexDFT--30.20805107; eV
thumbnail.jpeg/gas_opt h2Li, Qiangvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexDFT--6.76650618; eV
thumbnail.jpeg/gas_opt h2oLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexDFT--14.22269730; eV
thumbnail.jpeg/gas_opt nh3Li, Qiangvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexDFT--19.53534429; eV
thumbnail.jpeg/gas_opt ohLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexDFT--7.08120005; eV
thumbnail.jpeg/solvation/no_solvent bh3nh3Li, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexDFT--36.92071223; eV
thumbnail.jpeg/solvation/no_solvent ch3ohLi, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexDFT--30.20853760; eV
thumbnail.jpeg/solvation/no_solvent nh3Li, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexDFT--19.53746114; eV
thumbnail.jpeg/solvation/solvent bh3nh3Li, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexDFT--36.92071223; eV
thumbnail.jpeg/solvation/solvent ch3ohLi, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexDFT--30.20853760; eV
thumbnail.jpeg/solvation/solvent nh3Li, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexDFT--19.53746114; eV
thumbnail.jpeg/slabs_opt slab_Co2_Cu2Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--438.10302722; eV
thumbnail.jpeg/slabs_opt slab_Co_Cu1Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--433.98136627; eV
thumbnail.jpeg/slabs_opt slab_Co_Cu2Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--531.05509024; eV
thumbnail.jpeg/slabs_opt slab_Co_Cu3Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--623.08327378; eV
thumbnail.jpeg/slabs_opt slab_Co_OH2Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--428.27722956; eV
thumbnail.jpeg/slabs_opt slab_Cu111Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--223.83892255; eV
thumbnail.jpeg/xps/Cu111 0Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--223.96985680; eV
thumbnail.jpeg/xps/Cu111 1Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--509.62420424; eV
thumbnail.jpeg/xps/Cu111 2Li, Qiangvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexDFT--509.39856044; eV
Results 1-25 of 89 (Search time: 0.003 seconds).