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A reply to: "Response to Comment on "Density Functional Theory and 3D-RISM-KH molecular theory of solvation studies of CO2 reduction on Cu-, Cu2O-, Fe-, and Fe3O4-based nanocatalysts"".

Sergey Gusarov
Published in: Journal of molecular modeling (2022)
27:344-354, 2). This obvious fact which also comes from chemical properties of components should not be ignored.
Keyphrases
  • density functional theory
  • molecular dynamics
  • aqueous solution
  • metal organic framework
  • ionic liquid
  • molecular dynamics simulations
  • case control
  • visible light