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Item hits:

Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy
17-Oct-2017	/Solvation/h2o G10	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex	Geometry optimization	-	-	-155.69215238; eV
17-Oct-2017	/Solvation/h2o G8	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex	N/A	-	-	-169.25300607; eV
17-Oct-2017	/Solvation/h2o G4	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex	Geometry optimization	-	-	-154.47195922; eV
17-Oct-2017	/Solvation/h2o 2_methoyxphenol	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex	N/A	-	-	-106.12049978; eV
17-Oct-2017	/Solvation/h2o G3	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complex	N/A	-	-	-161.52120731; eV
17-Oct-2017	/Solvation/eg G1	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jun 6 2017 15:19:41) complex	Geometry optimization	-	-	-154.09067968; eV
30-Jul-2020	AC_BrCH2-Pt-Br-H-Hsc	Ruiz, Andrea	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex	Geometry optimization	DFT	-	-708.90488803; eV
17-Oct-2017	/Solvation/eg 2_methoyxphenol	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jun 6 2017 15:19:41) complex	Geometry optimization	-	-	-105.93879468; eV
17-Oct-2017	/Solvation/eg G2	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jun 6 2017 15:19:41) complex	Geometry optimization	-	-	-154.05264712; eV
17-Oct-2017	/Solvation/eg G10	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Jun 6 2017 15:19:41) complex	N/A	-	-	-155.72038572; eV

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