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Table 2 Structure of the quantum chemistry workflow library

From: Multi-level meta-workflows: new concept for regularly occurring tasks in quantum chemistry

Workflow library Sub-libraries
DOMAIN—quantum chemistry SUB-DOMAIN1—basic operations
  SUB-DOMAIN2—spectroscopic analysis
  SUB-DOMAIN3—optical benchmarking
  SUB-DOMAIN4—structural benchmarking
  SUB-DOMAIN5—inorganic polymerization catalysis