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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg17-Oct-2017/Gas_Geometries phenolLi, Qiangvasp; 5.3.3; 18Dez12 (build Jun 6 2017 15:19:41) complexN/A---82.89552213; eV
thumbnail.jpeg17-Oct-2017/Gas_Geometries CLi, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexN/A---266.64412947; eV
thumbnail.jpeg17-Oct-2017/Gas_Geometries G9Li, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexN/A---162.23932904; eV
thumbnail.jpeg17-Oct-2017/Gas_Geometries BLi, Qiangvasp; 5.3.3; 18Dez12 (build Jun 22 2017 15:26:47) complexN/A---266.63995884; eV
thumbnail.jpeg5-Nov-2018_Pt_hollowFako, Edvin-N/ADFT--
thumbnail.jpeg11-Feb-2019suzuki_trimer_bFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexN/ADFT--1991.77387466; eV
thumbnail.jpeg2-Oct-2023/CWO_del_config CWOBenzidi, Hindvasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complexN/ADFT--744.96158157; eV
thumbnail.jpeg2-Oct-2023/CWO_del_config CWO_H2O-OH3Benzidi, Hindvasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complexN/ADFT--748.29434418; eV
Login required2-Oct-2023ABX3Benzidi, Hindvasp; 6.3.0; 20Jan22 (build Feb 3 2022 14:08:09) complexN/ADFT--119.45094588; eV
thumbnail.jpeg2-Oct-2023/CoSbO4 CoSbO4_defectBenzidi, Hindvasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complexN/ADFT--109.77315040; eV
Results 41-50 of 231 (Search time: 0.001 seconds).