1. ioChem-Find
  2. Barcelona Supercomputing Center

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Mo3S4_benchmark_2020

CC-BY-4.0

The original dataset source can be reviewed here
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-6-34
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    • ROOT
      • B3LYP-D3(BJ)_BS1_optimized_structures
      • B3LYP_BS1_optimized_structures
      • B97D3_BS1_optimized_structures
      • BP86-D3(BJ)_BS1_optimized_structures
      • BP86_BS1_optimized_structures
      • M062X_BS1_optimized_structures
      • M06HF_BS1_optimized_structures
      • M06L_BS1_optimized_structures
      • M06_BS1_optimized_structures
      • M11_BS1_optimized_structures
      • PBE1PBE-D3(0)_BS1_optimized_structures
      • PBE1PBE-D3(BJ)_BS1_optimized_structures
      • PBE1PBE_BS1_optimized_structures
      • TPSS_BS1_optimized_structures
      • TPSSh_BS1_optimized_structures
      • wB97XD_BS1_optimized_structures

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