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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	13-Apr-2026	/Coadsorption/2NO2/alternate 2no2_alternate_freq	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.4.1; 05Apr23 (build May 28 2025 12:32:09) complex	Single point	DFT	-	-82.82517026; eV
	13-Apr-2026	/Coadsorption/2NO2/bridge 2no2_bridge_freq	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.4.1; 05Apr23 (build May 28 2025 12:32:09) complex	Single point	DFT	-	-83.07574516; eV
	13-Apr-2026	/Surfaces_H/Flat/025ML flat_025ML_freq	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.3.2; 27Jun22 (build May 23 2025 15:53:09) complex	Single point	DFT	-	-56.86359882; eV
	13-Apr-2026	/Coadsorption/2NO3/bridge 2no3_bridge_opt	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.4.1; 05Apr23 (build May 28 2025 12:32:09) complex	Single point	DFT	-	-94.14058277; eV
	13-Apr-2026	/Surfaces_H/Flat/1ML flat_1ML_opt	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.4.2; 20Jul23 (build May 01 2024 18:10:19) complex	Single point	DFT	-	-95.86220120; eV
	13-Apr-2026	/NOx_adsorbates/NO3/flat/1ML_H/bridge no3_flat_1ML_bridge_freq-H	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.4.1; 05Apr23 (build May 28 2025 12:32:09) complex	Single point	DFT	-	-120.05100827; eV
	13-Apr-2026	/NOx_adsorbates/NO2/Flat/050ML_H/bridge no2_flat_050ML_bridge-freq	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.3.2; 27Jun22 (build May 23 2025 15:53:09) complex	Single point	DFT	-	-88.99685976; eV
	13-Apr-2026	/NOx_adsorbates/NO2/Flat/1ML_H/bridge_short no2_flat_1ML_bridge_short	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.4.2; 20Jul23 (build May 01 2024 18:10:19) complex	Single point	DFT	-	-114.64923094; eV
	13-Apr-2026	/NOx_adsorbates/NO3/flat/1ML_H/bridge no3_flat_1ML_bridge_freq	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.4.1; 05Apr23 (build May 28 2025 12:32:09) complex	Single point	DFT	-	-120.03981667; eV
	13-Apr-2026	/NOx_adsorbates/NO2/Flat/025ML_H/bridge no2_flat_025ML_bridge	Floriano Costa, Gabriel; Barroso-Martinez, Jaxiry; Fenoll Silvestre, Didac Armand; Escudero-Escribano, María; Garcia Melchor, Max	vasp; 6.3.2; 27Jun22 (build May 23 2025 15:53:09) complex	Single point	DFT	-	-75.83100054; eV

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