1. Barcelona Supercomputing Center

Browsing by Author Schäfer, Tobias

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Showing results 1 to 15 of 15
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Apr-2021/Ce2O3_AF HF_Ce2O3_AFSchäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--100.03816203; eV
thumbnail.jpeg9-Apr-2021/Ce2O3_AF HSE03_Ce2O3_AFSchäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--53.13173219; eV
thumbnail.jpeg9-Apr-2021/Ce2O3_AF MP2c_Ce2O3_AFSchäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--
thumbnail.jpeg9-Apr-2021/Ce2O3_AF RPAc_Ce2O3_AFSchäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--
thumbnail.jpeg9-Apr-2021/Ce2O3_AF rSOX_Ce2O3_AFSchäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--
thumbnail.jpeg9-Apr-2021/CeO2 HF_CeO2Schäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--58.63391127; eV
thumbnail.jpeg9-Apr-2021/CeO2 HSE03_CeO2Schäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--31.53837316; eV
thumbnail.jpeg9-Apr-2021/CeO2 MP2c_CeO2Schäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--
thumbnail.jpeg9-Apr-2021/CeO2 RPAc_CeO2Schäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--
thumbnail.jpeg9-Apr-2021/CeO2 rSOX_CeO2Schäfer, Tobiasvasp; 6.1.0; 28Jan20 (build Oct 11 2020 21:02:46) complexSingle pointDFT--
thumbnail.jpeg9-Apr-2021/O2 HF_O2Schäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--30.32653272; eV
thumbnail.jpeg9-Apr-2021/O2 HSE03_O2Schäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--13.70844878; eV
thumbnail.jpeg9-Apr-2021/O2 MP2c_O2Schäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--
thumbnail.jpeg9-Apr-2021/O2 RPAc_O2Schäfer, Tobiasvasp; 6.0.8; 29Jun18 (build Feb 12 2019 18:48:11) complexSingle pointDFT--
thumbnail.jpeg9-Apr-2021/O2 rSOX_O2Schäfer, Tobiasvasp; 6.1.0; 28Jan20 (build Oct 11 2020 21:02:46) complexSingle pointDFT--
Showing results 1 to 15 of 15