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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeg/FePO4 10_EeOC_Cl_Clstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1252.90837418; eV
thumbnail.jpeg/FePO4 1_EaOC_Ou_Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1253.06994861; eV
thumbnail.jpeg/FePO4 1_EaOC_Ofc_Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1254.56262318; eV
thumbnail.jpeg/FePO4 1_EaOC_Cl_Hstrip_FinalScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1261.81406650; eV
thumbnail.jpeg/FePO4 1_EaOC_Cl_Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1261.81406650; eV
thumbnail.jpeg/FePO4 2_EaOC_Cl_Cladd_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1255.17963165; eV
thumbnail.jpeg/FePO4 3_EaOC_Ou_Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1246.68264044; eV
thumbnail.jpeg/FePO4 3_EaOC_Ofc_Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1247.08105944; eV
thumbnail.jpeg/FePO4 3_EaOC_Cl_Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1254.02787130; eV
thumbnail.jpeg/FePO4 4_EaOC_Cl_Clstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1247.19259606; eV
thumbnail.jpeg/FePO4 5_EaOC_Ofc_H-Clstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1247.08365130; eV
thumbnail.jpeg/FePO4 5_EaOC_Cl_H-Clstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1254.25428312; eV
thumbnail.jpeg/FePO4 6_EeOC_Cl_H-Clstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1247.19259606; eV
thumbnail.jpeg/FePO4 7_EeOC_Ofc-Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1246.53273785; eV
thumbnail.jpeg/FePO4 7_EeOC_Cl-Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1253.54820343; eV
thumbnail.jpeg/FePO4 8_EeOC_Cl-Cladd_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1253.71774302; eV
thumbnail.jpeg/FePO4 9_EeOC_Ofc-Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1252.73282597; eV
thumbnail.jpeg/FePO4 9_EeOC_Cl-Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1251.06633717; eV
thumbnail.jpeg/FePO4 11_EeOC_Cl_H-Clstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexDFT--1252.67550711; eV
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