Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg20-May-2019/FePO4 1_EaOC_Ofc_Hstrip_InitialScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1255.27033237; eV
thumbnail.jpeg20-May-2019/FePO4 1_EaOC_Cl_Hstrip_InitialScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1263.85671013; eV
thumbnail.jpeg20-May-2019/FePO4 2_EaOC_Cl_Cladd_FinalScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1256.93588718; eV
thumbnail.jpeg20-May-2019/FePO4 1_EaOC_Ofc_Hstrip_FinalScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1255.35455215; eV
thumbnail.jpeg20-May-2019/FePO4 2_EaOC_Cl_Cladd_InitialScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1255.20363405; eV
thumbnail.jpeg20-May-2019/FePO4 1_EaOC_Ofc_Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1254.56262318; eV
thumbnail.jpeg20-May-2019/FePO4 1_EaOC_Cl_Hstrip_FinalScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1261.81406650; eV
thumbnail.jpeg20-May-2019/FePO4 1_EaOC_Cl_Hstrip_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1261.81406650; eV
thumbnail.jpeg20-May-2019/FePO4 2_EaOC_Cl_Cladd_TSScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexFrequenciesDFT--1255.17963165; eV
thumbnail.jpeg20-May-2019/FePO4 3_EaOC_Ofc_Hstrip_InitialScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1249.28460674; eV
Results 1-10 of 54 (Search time: 0.001 seconds).

Discover

Program name
Method