Concepedia

A theoretical study of tetrabutylammonium [bis(1,3-dithiole-2-thione-4,5-dithiolato)bismuthate], [NBu4][Bi(dmit)2]: infrared spectrum in the solid state and solvation effects on the molecular geometry

Ana Maria Rocco, Robson Pacheco Pereira, José A. P. Bonapace, N.M. Comerlato, J.L. Wardell, Bruce F. Milne

Inorganica Chimica Acta · 2004 · 12 citations · 20 references

DOI

Concepts

References

20

General atomic and molecular electronic structure system

Michael W. Schmidt, Kim K. Baldridge, Jerry A. Boatz et al. · Journal of Computational Chemistry · 1993 · 20.1K citations

, , +18

Electrostatic interaction of a solute with a continuum. A direct utilizaion of AB initio molecular potentials for the prevision of solvent effects

Stanislav Miertuš, Eolo Scrocco, J. Tomasi · Chemical Physics · 1981 · 8.8K citations

, , +8

Harmonic Vibrational Frequencies:  An Evaluation of Hartree−Fock, Møller−Plesset, Quadratic Configuration Interaction, Density Functional Theory, and Semiempirical Scale Factors

Anthony P. Scott, Leo Radom · The Journal of Physical Chemistry · 1996 · 6.6K citations

, , +16

Metal bis-1,2-dithiolene complexes in conducting or magnetic crystalline assemblies

Neil Robertson, Leroy Cronin · Coordination Chemistry Reviews · 2002 · 606 citations

, , +2

An Introduction to molecular electronics

Choice Reviews Online · 1996 · 497 citations

, , +14