Browsing by Subject Potassium

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Showing results 1 to 13 of 13
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Aug-2021fe4co4_2Li_H2OJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-15043.9196929; Eh
thumbnail.jpeg30-Aug-2021fe4co4_2Na_H2OJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-15284.3458776; Eh
thumbnail.jpeg30-Aug-2021fe4co4_KJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-15483.4770735; Eh
thumbnail.jpeg30-Aug-2021fe4co4_K_H2OJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Single point StructureRPBEPBEGEN-15559.4640586; Eh
thumbnail.jpeg30-Aug-2021fe4co4_LiJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-14891.2897316; Eh
thumbnail.jpeg30-Aug-2021fe4co4_Li_2H2OJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-15043.9196929; Eh
thumbnail.jpeg30-Aug-2021fe4co4_Li_H2OJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-14967.6333872; Eh
thumbnail.jpeg30-Aug-2021fe4co4_NaJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-15045.9346420; Eh
thumbnail.jpeg30-Aug-2021fe4co4_Na_2H2OJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-15198.5364199; Eh
thumbnail.jpeg30-Aug-2021fe4co4_Na_H2OJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-15122.2591540; Eh
thumbnail.jpeg30-Aug-2021H2OJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-76.2837497981; Eh
thumbnail.jpeg30-Aug-2021Li(H2O)4Jover Modrego, JesúsGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-312.660656596; Eh
thumbnail.jpeg30-Aug-2021Na(H2O)6Jover Modrego, JesúsGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBEGEN-619.880125039; Eh