Crossref Cited-by Linking logo

Collect. Czech. Chem. Commun. 2003, 68, 240-252
https://doi.org/10.1135/cccc20030240

Application of MP2 Results in Comparative Studies of Semiempirical Ground-State Energies of Large Atoms

Jesus R. Floresa, Karol Jankowskib,* and Romuald Słupskic

a Departamento de Química Física y Química Orgánica, Universidad de Vigo, 36-200 Vigo, Spain
b Institute of Physics, Nicholas Copernicus University, 87-100 Toruń, Poland
c Computing Centre, Nicholas Copernicus University, 87-100 Toruń, Poland

Crossref Cited-by Linking

  • Lehtola Susi: A review on non‐relativistic, fully numerical electronic structure calculations on atoms and diatomic molecules. Int J of Quantum Chemistry 2019, 119. <https://doi.org/10.1002/qua.25968>
  • McCarthy Shane P., Thakkar Ajit J.: When does the non-variational nature of second-order Møller-Plesset energies manifest itself? All-electron correlation energies for open-shell atoms from K to Br. The Journal of Chemical Physics 2012, 136. <https://doi.org/10.1063/1.3679969>
  • McCarthy Shane P., Thakkar Ajit J.: Accurate all-electron correlation energies for the closed-shell atoms from Ar to Rn and their relationship to the corresponding MP2 correlation energies. The Journal of Chemical Physics 2011, 134. <https://doi.org/10.1063/1.3547262>
  • McCarthy Shane P., Thakkar Ajit J.: Simple models for electron correlation energies in atoms. Chemical Physics Letters 2010, 494, 312. <https://doi.org/10.1016/j.cplett.2010.05.095>
  • Thakkar Ajit J., McCarthy Shane P.: Toward improved density functionals for the correlation energy. The Journal of Chemical Physics 2009, 131. <https://doi.org/10.1063/1.3243845>
  • Perdew John P., Constantin Lucian A., Sagvolden Espen, Burke Kieron: Relevance of the Slowly Varying Electron Gas to Atoms, Molecules, and Solids. Phys. Rev. Lett. 2006, 97. <https://doi.org/10.1103/PhysRevLett.97.223002>
  • Jankowski K., Nowakowski K., Słupski R., Flores J. R.: Application of accurate MP2 energies for closed‐shell atoms in examinations of density functionals for 3d10 electron ions. Int J of Quantum Chemistry 2004, 99, 277. <https://doi.org/10.1002/qua.10855>
  • Ragot Sébastien, Cortona Pietro: Correlation energy of many-electron systems: A modified Colle–Salvetti approach. The Journal of Chemical Physics 2004, 121, 7671. <https://doi.org/10.1063/1.1792153>
  • Flores J. R., Słupski R., Jankowski K., Malinowski P.: Towards benchmark second-order correlation energies for large atoms: Zn2+ revisited. The Journal of Chemical Physics 2004, 121, 12334. <https://doi.org/10.1063/1.1821493>
  • Cordero N.A., Alonso J.A., March † N.H.: Relativistic theory of an inhomogeneous electron liquid in relation to atomic binding energies. Physics and Chemistry of Liquids An International Journal 2004, 42, 589. <https://doi.org/10.1080/00319100412331273398>