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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg20-May-2019/FePO4 4_EaOC_Cl_Clstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1247.19259606; eV
thumbnail.jpeg20-May-2019/FePO4 3_EaOC_Cl_Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1254.02787130; eV
thumbnail.jpeg20-May-2019/FePO4 5_EaOC_Ofc_H-Clstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1247.08365130; eV
thumbnail.jpeg20-May-2019/FePO4 6_EeOC_Cl_H-Clstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1247.19259606; eV
thumbnail.jpeg20-May-2019/FePO4 7_EeOC_Ofc-Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1246.53273785; eV
thumbnail.jpeg20-May-2019/FePO4 7_EeOC_Cl-Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1253.54820343; eV
thumbnail.jpeg20-May-2019/FePO4 9_EeOC_Cl-Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1251.06633717; eV
thumbnail.jpeg25-Feb-2021/Mechanisms/Electrolyte_Path/5_H C_FreqBrennan, Kevinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complexFrequenciesDFT--190.98437352; eV
thumbnail.jpeg25-Feb-2021/Mechanisms/Electrolyte_Path/7_H C_FreqBrennan, Kevinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complexFrequenciesDFT--199.66615583; eV
thumbnail.jpeg25-Feb-2021/Mechanisms/Coverage_Path/1_H N_Cov_FreqBrennan, Kevinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complexFrequenciesDFT--170.71996485; eV
Results 21-30 of 506 (Search time: 0.002 seconds).