ioChem-BD Browse - Barcelona Supercomputing Center: Barbaralyl_Cation

Barbaralyl_Cation_Benchmark Collection home page

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Please use this identifier to cite or link to this collection: DOI: 10.19061/iochem-bd-6-371

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ROOT
- 631Gd
  - APFD
  - B1B95
  - B1LYP
  - B3LYP
  - B3PW91
  - B97D3
  - BHandHLYP
  - BLYP
  - BMK
  - CAM_B3LYP
  - D3BJ_B3LYP
  - D3BJ_BLYP
  - D3BJ_CAM_B3LYP
  - D3BJ_PBE1PBE
  - D3BJ_PBEPBE
  - HSEH1PBE
  - LC_wHPBE
  - M06
  - M062X
  - M06L
  - M11
  - MN12L
  - MN12SX
  - MN15
  - N12SX
  - O3LYP
  - PBE1PBE
  - PBEPBE
  - PBEh1PBE
  - PW6B95D3
  - SOGGA11X
  - TPSSTPSS
  - TPSSh
  - X3LYP
  - mpw1pw91
  - revTPSSrevTPSS
  - tHCTHhyb
  - wB97X
  - wB97XD
- def2SVP
  - APFD
  - B1B95
  - B1LYP
  - B3LYP
  - B3PW91
  - B97D3
  - BHandHLYP
  - BLYP
  - BMK
  - CAM_B3LYP
  - D3BJ_B3LYP
  - D3BJ_BLYP
  - D3BJ_CAM_B3LYP
  - D3BJ_PBE1PBE
  - D3BJ_PBEPBE
  - HSEH1PBE
  - LC_wHPBE
  - M06
  - M062X
  - M06L
  - M11
  - MN12L
  - MN12SX
  - MN15
  - N12SX
  - O3LYP
  - PBE1PBE
  - PBEPBE
  - PBEh1PBE
  - PW6B95D3
  - SOGGA11X
  - TPSSTPSS
  - TPSSh
  - X3LYP
  - mpw1pw91
  - revTPSSrevTPSS
  - tHCTHhyb
  - wB97X
  - wB97XD
- wB97XD_def2TZVP

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