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A.N.Nesmeyanov Institute of Organoelement Compounds - Russian Academy of Sciences


Moscow
Russian Federation

www.ineos.ac.ru/
More about A.N.Nesmeyanov Institute of Organoelement Compounds - Russian Academy of Sciences
  • News

    Density functional theory took a wrong turn recently

    The paper explores in detail the intricate relationship between the results of the quantum-chemical calculations and the approximations they rely upon. When chemists want (or need) to include some "theory" in their papers, it usually means that they will perform some quantum-chemical calcul ... more

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