𝔖 Bobbio Scriptorium
✦   LIBER   ✦

The reaction mechanisms of boron amidinate and small molecules: a density function theory study

✍ Scribed by Longhua Yang; Xingye Ren; Hongming Wang; Ning Zhang; Sanguo Hong

Book ID
106518047
Publisher
Springer Netherlands
Year
2011
Tongue
English
Weight
892 KB
Volume
38
Category
Article
ISSN
0922-6168

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Structure and stability of small boron c
Structure and stability of small boron clusters. A density functional theoretical study
✍ Ihsan Boustani πŸ“‚ Article πŸ“… 1995 πŸ› Elsevier Science 🌐 English βš– 395 KB

The structure and stability of small boron clusters B,, (n = 2-14) have been investigated employing density functional theory. The search for minima was performed using gradient methods at the local spin density level. Most of the final structures prefer planar or quasi-planar forms and can be consi

Infrared and Raman spectra of binuclear
Infrared and Raman spectra of binuclear aromatic molecules: a density functional theory study
✍ Fabrizia Negri; Giorgio Orlandi πŸ“‚ Article πŸ“… 1998 πŸ› John Wiley and Sons 🌐 English βš– 325 KB πŸ‘ 2 views

The vibrational force Ðelds of trans-stilbene, cis-stilbene, trans-4,4ΒΊ-diΓ‘uorostilbene and trans-azobenzene were computed by employing gradient corrected density functional theory. Raman intensities were evaluated by numerical second di †erentiation of energy gradients and used together with comput