Concepedia

Regular adsorption of CO molecules on LiF(001)

Mauro Causà, Roberto Dovesi, F. Ricca

Surface Science · 1993 · 28 citations · 15 references

DOI

Concepts

References

15

The influence of polarization functions on molecular orbital hydrogenation energies

P. C. Hariharan, John A. Pople · Theoretical Chemistry Accounts · 1973 · 15.7K citations

, , +14

Self-consistent molecular orbital methods. 21. Small split-valence basis sets for first-row elements

J. Stephen Binkley, John A. Pople, Warren J. Hehre · Journal of the American Chemical Society · 1980 · 3.9K citations

, , +7

Pseudopotential Hartree-Fock study of seventeen III-V and IV-IV semiconductors

Mauro Causà, Roberto Dovesi, C. Roetti · Physical review. B, Condensed matter · 1991 · 245 citations

, , +17

Analysis of the effect of electron correlation on charge density distributions

Kenneth B. Wiberg, Christopher M. Hadad, Teresa J. LePage et al. · The Journal of Physical Chemistry · 1992 · 229 citations

, , +10

Molecular orbital cluster model study of bonding and vibrations of CO adsorbed on MgO surface

Gianfranco Pacchioni, Giuseppe Cogliandro, Paul S. Bagus · International Journal of Quantum Chemistry · 1992 · 229 citations

, , +17