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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg1-Dec-2016/ts 16_01_cLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexSingle point---659.95285190; eV
thumbnail.jpeg1-Dec-2016/ts 11_14_cLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexSingle point---662.95618459; eV
thumbnail.jpeg11-Apr-2017/Ni3P2/freq OHLi, Qiangvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexSingle point---537.23146038; eV
thumbnail.jpeg11-Apr-2017/NiCo2P2/opt 2x2Li, Qiangvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexSingle point---587.33697528; eV
thumbnail.jpeg11-Apr-2017/Ni3P2/opt ts_7b6bLi, Qiangvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexSingle point---572.22073839; eV
thumbnail.jpeg1-Dec-2016/ts 12_12_cLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexSingle point---663.58246273; eV
thumbnail.jpeg1-Dec-2016/intermediateds 02_cLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexSingle point---657.11876415; eV
thumbnail.jpeg1-Dec-2016/intermediateds oh_slabLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexSingle point---575.08060529; eV
thumbnail.jpeg11-Apr-2017/Ni3P2/opt ts_3b4bLi, Qiangvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexSingle point---578.03189124; eV
thumbnail.jpeg1-Dec-2016/ts 01_13_rLi, Qiangvasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexSingle point---663.41688377; eV
Results 1-10 of 304 (Search time: 0.001 seconds).