SnB 2.0 Parameters (>1.1Ĺ)

SnB 2.0 Parameters (>1.1Ĺ)

• Peaks
  • 0.4n if “heavy” atoms present
  • 0.8n if all C,N,O
• Phase Refinement
  • Unrestricted Parameter Shift
• Cycles
  • n/2 if n<400 and “heavy” atoms present
  • n otherwise

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