Band
Title
5710.0 cm-1: 4ν3 of (CO3)2- in Calcite
Type
absorption
Assignments summary
Assignment Symmetry Mode Specie(s) Molecule/Atom Bond Multiplicity Degeneracy Contribution Resonance
3 stretching asym. (CO3)2- (CO3)2- unknown
Characteristics summary
Peak position
(cm-1)
Center position
(cm-1)
Width
(cm-1)
Shape Asymmetry factor Peak intensity
(cm-1)
Peak intensity relative Peak strength Integrated intensity
(cm-2)
Integrated intensity relative Integrated strength Temperature
(K)
Pressure
(bar)
5710 ± 30 - 180 ± 20 asymmetric 2.5e-06 vw 295.0 1
Label
3
Category
overtone vibration

Evaluation

Level
fully assigned
Evaluation
undefined
Comments
attribution SSHADE
# Multiplicity type Degeneracy Other band
1 unknown

Vibration modes

Label (type)
3 (stretching asym.)       Bond: (CO3)2-
Comments
C-O asymmetric stretch

Temperature

Temperature
295.0 ± 5.0 K

Pressure

Pressure
1 bar
Method #1
various
Overlap
unknown
Peak
5710 ± 30 cm-1 (fit peak)
Evaluation
validated
Quality
E
FWHM
180 ± 20 cm-1 (fwhm)
Shape
asymmetric
Evaluation
validated
Quality
E
Method
baseline corrected peak intensity
Relative intensity
2.5e-06 ± 5.0e-06
Strength
very weak (vw)
Evaluation
undefined
Quality
E