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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg11-Apr-2017/Ni3P2/opt H2Li, Qiangvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexGeometry optimization---534.00808979; eV
thumbnail.jpeg11-Apr-2017/Ni3P2/opt H_topLi, Qiangvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexGeometry optimization---530.12722503; eV
thumbnail.jpeg11-Apr-2017/Ni3P2/opt 4B4Li, Qiangvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexGeometry optimization---579.28605658; eV
thumbnail.jpeg11-Apr-2017/Ni3P2/opt 1x1Li, Qiangvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---131.74111377; eV
thumbnail.jpeg11-Apr-2017/Ni3P2/opt OHLi, Qiangvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexGeometry optimization---538.16085256; eV
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