Concepedia

Vibrational spectra and structure of RDX and its 13C- and 15N-labeled derivatives: A theoretical and experimental study

Ricardo Infante‐Castillo, Leonardo C. Pacheco‐Londoño, Samuel P. Hernández‐Rivera

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2010 · 41 citations · 16 references

DOI

Concepts

References

16

Density-functional thermochemistry. III. The role of exact exchange

Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations

, , +13

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 100.1K citations

, , +17

Density Functional Theory of Electronic Structure

W. Kohn, Axel D. Becke, Robert G. Parr · The Journal of Physical Chemistry · 1996 · 3.4K citations

, , +17

The crystal structure of cyclotrimethylenetrinitramine

C. S. Choi, E. Prince · Acta Crystallographica Section B · 1972 · 480 citations

, , +12

Density functional vibrational analysis using wavenumber-linear scale factors

Hiroshi Yoshida, Akito Ehara, Hiroatsu Matsuura · Chemical Physics Letters · 2000 · 230 citations

, , +5