Concepedia
Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2022 · 21 citations · 56 references
Open access
BiochemistryNatural SciencesThermal BehaviorFolic AcidChemistrySodium Folate Salts
56
Density-functional thermochemistry. III. The role of exact exchange
Axel D. Becke · The Journal of Chemical Physics · 1993 · 101.1K citations
Electron Density, Chemical Thermodynamics, Engineering +13
<i>VESTA 3</i> for three-dimensional visualization of crystal, volumetric and morphology data
Koichi Momma, Fujio Izumi · Journal of Applied Crystallography · 2011 · 23.9K citations
Introduction to infrared and Raman spectroscopy
Upali A. Jayasooriya · Spectrochimica Acta Part A Molecular Spectroscopy · 1991 · 3K citations
Optical Properties, Spectroscopy, Natural Sciences +3
Density-functional thermochemistry. IV. A new dynamical correlation functional and implications for exact-exchange mixing
Axel D. Becke · The Journal of Chemical Physics · 1996 · 2.7K citations
Engineering, Computational Chemistry, Chemistry +18
New Scale Factors for Harmonic Vibrational Frequencies Using the B3LYP Density Functional Method with the Triple-ζ Basis Set 6-311+G(d,p)
Martin Andersson, P. Uvdal · The Journal of Physical Chemistry A · 2005 · 1.6K citations
Engineering, Physics, Natural Sciences +13