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 6_EeOC_Cl_H-Clstrip_FinalScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1247.86736159; eV
thumbnail.jpeg20-May-2019/FePO4 7_EeOC_Ofc-Hstrip_InitialScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1247.95361862; eV
thumbnail.jpeg20-May-2019/FePO4 7_EeOC_Ofc-Hstrip_FinalScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1248.82778487; eV
thumbnail.jpeg20-May-2019/FePO4 7_EeOC_Cl-Hstrip_InitialScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1253.21445629; eV
thumbnail.jpeg20-May-2019/FePO4 7_EeOC_Cl-Hstrip_FinalScharfe, Matthiasvasp; 5.3.5; 31Mar14 (build Sep 08 2015 12:23:17) complexGeometry optimizationDFT--1253.21445629; 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
Results 201-208 of 208 (Search time: 0.002 seconds).

Discover

Program name
Calculation type
Method