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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	5-Feb-2024	/Adsorptions/Cu(111) vdW-CH₃O-Cu	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-276.88026240; eV
	5-Feb-2024	/Adsorptions/Cu(111) vdW-HCOO-Cu	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-276.80835998; eV
	5-Feb-2024	/Adsorptions/Cu(111) vdW-H₂-Cu	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-253.54053537; eV
	5-Feb-2024	/Adsorptions/Cu(111) vdW-CO-Cu	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-269.33309113; eV
	5-Feb-2024	/Adsorptions/Cu(111) vdW-CO₂-Cu	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-269.33309113; eV
	5-Feb-2024	/Adsorptions/Cu(111) vdW-surf-Cu	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-246.15566238; eV
	5-Feb-2024	/Adsorptions/m-ZrO₂ vdW-H₂-ZrO₂	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-1961.71801604; eV
	5-Feb-2024	/Adsorptions/m-ZrO₂ vdW-CO-ZrO₂	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-1970.40283639; eV
	5-Feb-2024	/Adsorptions/m-ZrO₂ vdW-CH₃O-ZrO₂	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-1986.78883475; eV
	5-Feb-2024	/Adsorptions/m-ZrO₂ vdW-HCOO-ZrO₂	Morales-Vidal, Jordi	vasp; 6.4.2; 20Jul23 (build Nov 03 2023 15:27:38) complex	N/A	DFT	-	-1986.99348194; eV

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