Concepedia

Synthesis and characterization of two new N4O2 macroacyclic Schiff-base ligands containing piperazine moiety and mononuclear Co(III) and Cu(II) complexes, spectral, X-ray crystal structural, theoretical studies, cytotoxic and antibacterial properties

Hassan Keypour, Masoumeh Mahmoudabadi, Amir Shooshtari, Mehdi Bayat, Mitra Ghassemzadeh, Leila Hosseinzadeh, Fariba Mohsenzadeh, Klaus Harms

Polyhedron · 2017 · 31 citations · 44 references

DOI

Concepts

References

44

Density-functional exchange-energy approximation with correct asymptotic behavior

Axel D. Becke · Physical review. A, General physics · 1988 · 53.5K citations

, , +17

<i>SHELXT</i>– Integrated space-group and crystal-structure determination

George M. Sheldrick · Acta Crystallographica Section A Foundations and Advances · 2014 · 28.6K citations · Full text

, , +16

Density-functional approximation for the correlation energy of the inhomogeneous electron gas

John P. Perdew · Physical review. B, Condensed matter · 1986 · 18.7K citations

, , +11

Fully optimized contracted Gaussian basis sets for atoms Li to Kr

Ansgar Schäfer, Hans W. Horn, Reinhart Ahlrichs · The Journal of Chemical Physics · 1992 · 9.6K citations

, , +11

On the calculation of bonding energies by the Hartree Fock Slater method

Tom Ziegler, Arvi Rauk · Theoretical Chemistry Accounts · 1977 · 2.4K citations

, , +12