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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0 5_H2O	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-297.28003035; eV
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0_5 4_COCO_from_COCOK	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-312.12747314; eV
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0_5 4_COCOH	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-315.79866448; eV
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0_5 4_CO+CO	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-313.50086135; eV
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0_5 1_CO2	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-305.54681806; eV
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0 5_OH_H	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-296.97946107; eV
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0_5 3_COH	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-300.39579443; eV
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0_5 3_CHO	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-300.72130945; eV
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0_5 2_CO	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-297.84490689; eV
	31-May-2022	/Cu-CO2_111/Cu-CO2_111_strain0_5 0_H	Yin, Jun	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 05 2022 20:32:27) complex	Single point	DFT	-	-286.08338107; eV

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