CO_on_ceria(100) Collection home page

Share - copy and redistribute the material in any medium or format. Adapt - remix, transform, and build upon the material for any purpose, even commercially. The licensor cannot revoke these freedoms as long as you follow the license terms.

Please use this identifier to cite or link to this collection: DOI: 10.19061/iochem-bd-1-104

No other publication derived

Browse
Collection's Items (Sorted by Submit Date in Descending order): 1 to 15 of 15
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required5-Nov-20181Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--872.67667134; eV
Login required5-Nov-20182Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--872.61506037; eV
Login required5-Nov-20183Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--872.35035214; eV
Login required5-Nov-20184Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--872.72582003; eV
Login required5-Nov-20185Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--872.71058198; eV
Login required5-Nov-20186Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--872.66621823; eV
Login required5-Nov-20187Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--872.32525414; eV
Login required5-Nov-20188Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--872.65378135; eV
Login required5-Nov-20189Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--872.68993178; eV
Login required5-Nov-201810Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--1744.90453972; eV
Login required5-Nov-201811Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--1745.03908288; eV
Login required5-Nov-201812Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--1644.98581747; eV
Login required5-Nov-201813Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--1645.11465487; eV
Login required5-Nov-201814Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--1645.01343891; eV
Login required5-Nov-201815Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build May 07 2014 17:30:20) gamma-onlyGeometry optimizationDFT--1645.10092586; eV
Collection's Items (Sorted by Submit Date in Descending order): 1 to 15 of 15
RSS Feed RSS Feed RSS Feed

Discover

Program name
Calculation type
Method