Browsing by Author Petrus, Enric

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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeg0e_reducedPetrus, EnricADF; 2019OPBETZP-
thumbnail.jpeg12e_reducedPetrus, EnricADF; 2019OPBETZP-
thumbnail.jpeg18e_reducedPetrus, EnricADF; 2019OPBETZP-
thumbnail.jpeg1_u2o4_o2Petrus, EnricADF; 2016PBETZP-
thumbnail.jpeg1e_reducedPetrus, EnricADF; 2019OPBETZP-
thumbnail.jpeg1ts_h2Petrus, EnricADF; 2016PBETZP-
thumbnail.jpeg1ts_h2_waPetrus, EnricADF; 2016PBETZP-
thumbnail.jpeg24e_reducedPetrus, EnricADF; 2019OPBETZP-
thumbnail.jpeg2H2O_B3LYPPetrus, EnricADF; 2019B3LYPTZP-1.27517524; Eh
thumbnail.jpeg2H2O_BLYPPetrus, EnricADF; 2019BLYPTZP-1.02900002; Eh
thumbnail.jpeg2H2O_BPPetrus, EnricADF; 2019BP86TZP-1.05685955; Eh
thumbnail.jpeg2H2O_PBE0Petrus, EnricADF; 2019PBE0 == Not Default ==TZP-1.36240350; Eh
thumbnail.jpeg3_u2o2oh2_4pyPetrus, EnricADF; 2016PBETZP-
thumbnail.jpeg3_u2o3oh_4pyPetrus, EnricADF; 2016PBETZP-
thumbnail.jpeg3_u2o4_2pyPetrus, EnricADF; 2016PBETZP-
thumbnail.jpeg3_u2o4_4pyPetrus, EnricADF; 2016PBETZP-
thumbnail.jpeg3_u2o4_o2Petrus, EnricADF; 2016PBETZP-
thumbnail.jpeg3ts_u2o4_4pyPetrus, EnricADF; 2016PBETZP-
thumbnail.jpeg3ts_u2o4_4py_waPetrus, EnricADF; 2016PBETZP-
thumbnail.jpeg6e_reducedPetrus, EnricADF; 2019OPBETZP-
Showing results 1 to 20 of 620