Bandlist BANDLIST_ABS_CO2_CO2-I

Band list reference

Schmitt, Bernard and The SSHADE Band List Committee (2021): Absorption band list of CO2 in solid CO2 (phase I). Version 1. SSHADE (OSUG Data Center). Dataset/Band list Data. https://doi.org/10.26302/SSHADE/BANDLIST_ABS_CO2_CO2-I

Publication(s)

Bandlist type

Type: absorption
Description: FIR-MIR-NIR-VUV absorption band list of the isotopes of CO₂ in solid CO₂ (phase I)
Number of bands: 115

Associated data

Other bandlists of this constituent

Raman band list of CO2 in solid CO2 (phase I)

Parent spectra

Constituent and primary specie

Constituent: CO2 - phase I
Primary specie: CO₂ (Carbon dioxide)

Bands

Position (cm^-1)

Width (cm^-1)

Peak intensity (cm^-1)

Relative intensity

Strength

Transition mode

Mode type(s)

Bond

Specie(s)

Degeneracy

Resonances

68 ± 0.5

4 ± 0.5

ν_T (T_u⁻)

translation

¹²C¹⁶O₂

114 ± 0.5

7 ± 0.5

ν[ ]T (T_u⁺)

translation

¹²C¹⁶O₂

638.8 ± 0.3

585 ± 50

ν₂

bending

¹³C¹⁶O₂

double

651.3 ± 0.2

ν₂

bending

¹²C¹⁶O¹⁸O

double

654.7 ± 0.3

± 0.1

6680 ± 100

ν₂

bending

¹²C¹⁶O₂

double

660 ± 1

6350 ± 100

ν₂

bending

¹²C¹⁶O₂

double

1915 ± 0.2

2 ± 0.1

4.15 ± 0.05

unknown

¹²C¹⁶O₂

1936.2 ± 0.2

6.8 ± 0.2

9.5 ± 0.1

unknown

¹²C¹⁶O₂

2023.2 ± 0.2

1.65 ± 0.1

1.05 ± 0.05

unknown

¹²C¹⁶O₂

2028.3 ± 0.2

2.9 ± 0.2

0.45 ± 0.05

unknown

¹²C¹⁶O₂

2041.7 ± 0.2

5.8 ± 0.2

31 ± 0.5

unknown

¹²C¹⁶O₂

2065.5 ± 0.2

1.35 ± 0.1

2.4 ± 0.1

unknown

¹²C¹⁶O₂

2282.4 ± 0.4

3200 ± 100

ν₃

stretching asym.

≥ ¹³C-¹⁶O-

¹³C¹⁶O₂

2327.1 ± 0.2

ν₃

stretching asym.

≥ ¹²C-¹⁸O-

¹²C¹⁶O¹⁸O

2343.7 ± 1.3

39600 ± 200

vvs

ν₃

stretching asym.

≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

2459.5 ± 0.5

21 ± 3

125 ± 25

unknown

¹²C¹⁶O₂

2607.8 ± 0.2

1.35 ± 0.1

0.31 ± 0.02

unknown

¹²C¹⁶O₂

2660 ± 0.2

1.35 ± 0.1

0.06 ± 0.005

vvw

unknown

¹²C¹⁶O₂

2721.2 ± 0.2

15.5 ± 0.5

0.19 ± 0.005

unknown

¹²C¹⁶O₂

2740 ± 0.2

1.4 ± 0.1

0.056 ± 0.005

vvw

unknown

¹²C¹⁶O₂

2767 ± 0.2

1.6 ± 0.2

0.04 ± 0.005

vvw

unknown

¹²C¹⁶O₂

2840 ± 0.3

21 ± 1

0.048 ± 0.005

vvw

unknown

¹²C¹⁶O₂

2937.6 ± 0.2

8.2 ± 0.3

0.12 ± 0.01

unknown

¹²C¹⁶O₂

3001.5 ± 0.3

15.6 ± 0.5

3.14 ± 0.05

unknown

¹²C¹⁶O₂

3006.2 ± 0.3

20 ± 0.5

3.24 ± 0.05

unknown

¹²C¹⁶O₂

3155.1 ± 0.2

1.5 ± 0.1

0.034 ± 0.002

vvw

unknown

¹²C¹⁶O₂

3187.9 ± 0.2

7.4 ± 0.2

0.1 ± 0.005

vvw

unknown

¹²C¹⁶O₂

3304.5 ± 0.2

1.6 ± 0.1

0.027 ± 0.005

vvw

unknown

¹²C¹⁶O₂

3319 ± 0.3

1.5 ± 0.3

0.15 ± 0.02

unknown

¹²C¹⁶O₂

3324.1 ± 0.3

5.7 ± 0.2

1.1 ± 0.05

unknown

¹²C¹⁶O₂

3443 ± 0.2

5.5 ± 0.2

0.6 ± 0.05

unknown

¹²C¹⁶O₂

3478.7 ± 0.3

1.5 ± 0.5

0.2 ± 0.03

unknown

¹²C¹⁶O₂

3481.4 ± 0.3

1.5 ± 0.5

0.25 ± 0.03

unknown

¹²C¹⁶O₂

3486.7 ± 0.2

2 ± 0.5

0.4 ± 0.03

unknown

¹²C¹⁶O₂

3513.8 ± 0.3

1.8 ± 0.1

27 ± 2

unknown

¹²C¹⁶O₂

3562.5 ± 0.2

2.1 ± 0.1

28 ± 2

unknown

¹²C¹⁶O₂

3580.7 ± 0.2

2.1 ± 0.1

4.4 ± 0.2

unknown

¹²C¹⁶O₂

3599.3 ± 0.3

2.3 ± 0.1

3200 ± 100

2ν₂+ν₃

bending
stretching asym.

¹²C¹⁶O₂
≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

3632.2 ± 0.2

2.5 ± 0.1

105 ± 10

unknown

¹²C¹⁶O₂

3667.3 ± 0.2

2.6 ± 0.2

33 ± 5

unknown

¹²C¹⁶O₂

3686.3 ± 0.2

2.4 ± 0.2

6.5 ± 0.5

unknown

¹²C¹⁶O₂

3707.8 ± 0.3

2.7 ± 0.1

7600 ± 200

ν₁+ν₃

stretching sym.
stretching asym.

≥ ¹²C-¹⁶O-
≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

3778.5 ± 1

6 ± 0.5

4 ± 1.5

unknown

¹²C¹⁶O₂

3803 ± 1

22 ± 1

17 ± 2

unknown

¹²C¹⁶O₂

3822.5 ± 1.5

5 ± 3

unknown

¹²C¹⁶O₂

4255.3 ± 0.3

3.2 ± 0.5

0.04 ± 0.005

vvw

unknown

¹²C¹⁶O₂

4362.7 ± 0.2

3.4 ± 0.3

0.085 ± 0.05

vvw

unknown

¹²C¹⁶O₂

4588.6 ± 0.2

5 ± 1

0.02 ± 0.005

vvw

unknown

¹²C¹⁶O₂

4634 ± 1.6

2.6 ± 0.2

0.085 ± 0.005

vvw

unknown

¹²C¹⁶O₂

4697 ± 0.6

7 ± 0.5

0.09 ± 0.005

vvw

unknown

¹²C¹⁶O₂

4713.3 ± 0.2

5.5 ± 1

0.04 ± 0.005

vvw

unknown

¹²C¹⁶O₂

4722 ± 0.5

1.9 ± 0.2

0.13 ± 0.005

unknown

¹²C¹⁶O₂

4774 ± 0.3

2.3 ± 0.2

0.21 ± 0.01

unknown

¹²C¹⁶O₂

4790.8 ± 0.2

4.9 ± 0.3

0.19 ± 0.01

unknown

¹²C¹⁶O₂

4830.5 ± 0.2

2.05 ± 0.1

26 ± 1

4ν₂+ν₃

bending
stretching asym.

¹²C¹⁶O₂
≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

4877.5 ± 1

2 ± 0.1

1.7 ± 0.1

unknown

¹²C¹⁶O₂

4897.5 ± 1.2

2.5 ± 0.3

1 ± 0.1

unknown

¹²C¹⁶O₂

4932 ± 1

2.2 ± 0.2

0.13 ± 0.02

unknown

¹²C¹⁶O₂

4946.5 ± 0.7

2.2 ± 0.3

0.18 ± 0.03

unknown

¹²C¹⁶O₂

4957.8 ± 0.3

2 ± 0.5

0.3 ± 0.1

unknown

¹²C¹⁶O₂

4971 ± 0.3

2.25 ± 0.1

132 ± 4

ν₁+ν₂+ν₃

stretching sym.
bending
stretching asym.

≥ ¹²C-¹⁶O-
¹²C¹⁶O₂
≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

4985.5 ± 1.5

1.8 ± 0.3

1.6 ± 0.2

unknown

¹²C¹⁶O₂

4998.7 ± 0.2

11.5 ± 1

0.5 ± 0.1

unknown

¹²C¹⁶O₂

5026 ± 0.8

2.5 ± 0.3

0.2 ± 0.05

unknown

¹²C¹⁶O₂

5038.5 ± 1.3

15 ± 3

0.4 ± 0.1

unknown

¹²C¹⁶O₂

5053 ± 0.2

0.2 ± 0.1

unknown

¹²C¹⁶O₂

5065.3 ± 0.3

2.4 ± 0.3

0.1 ± 0.02

vvw

unknown

¹²C¹⁶O₂

5086.7 ± 0.2

2.4 ± 0.1

80 ± 2

2ν₁+ν₃

stretching sym.
stretching asym.

≥ ¹²C-¹⁶O-
≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

5117.1 ± 0.2

11 ± 2

0.4 ± 0.1

unknown

¹²C¹⁶O₂

5139 ± 1

22 ± 5

0.35 ± 0.2

unknown

¹²C¹⁶O₂

5181.5 ± 0.5

22 ± 3

0.15 ± 0.02

unknown

¹²C¹⁶O₂

5303 ± 0.6

1.8 ± 0.1

0.225 ± 0.005

unknown

¹²C¹⁶O₂

5322.5 ± 0.3

3.5 ± 1

0.009 ± 0.003

unknown

¹²C¹⁶O₂

5324.5 ± 0.5

3.5 ± 1

0.006 ± 0.003

unknown

¹²C¹⁶O₂

5337.7 ± 0.3

22 ± 3

0.04 ± 0.005

vvw

unknown

¹²C¹⁶O₂

6044 ± 1

2.25 ± 0.1

0.14 ± 0.005

6ν₂+ν₃

bending
stretching asym.

¹²C¹⁶O₂
≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

6099.8 ± 0.2

1.2 ± 0.1

0.018 ± 0.001

vvw

unknown

¹²C¹⁶O₂

6112.2 ± 0.2

1.8 ± 0.1

0.014 ± 0.005

vvw

unknown

¹²C¹⁶O₂

6213.5 ± 0.4

2 ± 0.1

2.2 ± 0.1

ν₁+4ν₂+ν₃

stretching sym.
bending
stretching asym.

≥ ¹²C-¹⁶O-
¹²C¹⁶O₂
≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

6236.3 ± 0.3

1.25 ± 0.1

0.055 ± 0.005

vvw

unknown

¹²C¹⁶O₂

6241.7 ± 0.3

2 ± 0.2

0.01 ± 0.002

unknown

¹²C¹⁶O₂

6272.5 ± 0.5

10 ± 5

0.015 ± 0.002

vvw

unknown

¹²C¹⁶O₂

6286.5 ± 0.5

10 ± 5

0.012 ± 0.002

vvw

unknown

¹²C¹⁶O₂

6339 ± 0.2

2 ± 0.1

3.7 ± 0.1

2ν₁+2ν₂+ν₃

stretching sym.
bending
stretching asym.

≥ ¹²C-¹⁶O-
¹²C¹⁶O₂
≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

6351.5 ± 0.2

1.1 ± 0.2

0.015 ± 0.002

vvw

unknown

¹²C¹⁶O₂

6482 ± 0.5

2.65 ± 0.1

0.4 ± 0.005

3ν₁+ν₃

stretching sym.
stretching asym.

≥ ¹²C-¹⁶O-
≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

6518.5 ± 0.2

2.9 ± 0.1

0.005 ± 0.001

unknown

¹²C¹⁶O₂

6663.6 ± 0.2

2.3 ± 0.2

0.0055 ± 3.0e-04

unknown

¹²C¹⁶O₂

6669.5 ± 0.3

3.1 ± 0.3

0.0018 ± 2.0e-04

unknown

¹²C¹⁶O₂

6777 ± 0.2

2.65 ± 3

0.07 ± 0.005

vvw

unknown

¹²C¹⁶O₂

6920.1 ± 0.2

4.5 ± 0.3

0.016 ± 0.002

vvw

unknown

¹²C¹⁶O₂

6935.7 ± 0.2

4.5 ± 0.3

0.01 ± 0.003

unknown

¹²C¹⁶O₂

6950.2 ± 0.3

5 ± 1.5

0.01 ± 0.005

unknown

¹²C¹⁶O₂

6969.2 ± 0.8

2.25 ± 0.1

9.1 ± 0.1

3ν₃

stretching asym.

≥ ¹²C-¹⁶O-

¹²C¹⁶O₂

6997.9 ± 0.2

6 ± 2

0.07 ± 0.02

vvw

unknown

¹²C¹⁶O₂

7015.5 ± 0.3

30 ± 10

0.08 ± 0.02

vvw

unknown

¹²C¹⁶O₂

7436.9 ± 0.2

2.8 ± 0.1

0.013 ± 5.0e-04

vvw

unknown

¹²C¹⁶O₂

7584.8 ± 0.3

3.15 ± 0.1

0.044 ± 0.001

vvw

unknown

¹²C¹⁶O₂

7717.7 ± 0.3

3.2 ± 0.1

0.02 ± 5.0e-04

vvw

unknown

¹²C¹⁶O₂

7892 ± 0.2

5.4 ± 0.2

9.0e-04 ± 1.0e-04

unknown

¹²C¹⁶O₂

7966.4 ± 0.3

2.1 ± 0.1

0.00125 ± 1.0e-04

unknown

¹²C¹⁶O₂

8087.6 ± 0.2

2.25 ± 0.1

0.0044 ± 1.0e-04

unknown

¹²C¹⁶O₂

8180 ± 0.2

4.6 ± 0.2

0.083 ± 0.002

vvw

unknown

¹²C¹⁶O₂

8265.5 ± 0.5

30 ± 5

0.004 ± 5.0e-04

unknown

¹²C¹⁶O₂

8289.5 ± 0.2

5 ± 0.2

0.175 ± 0.005

unknown

¹²C¹⁶O₂

8360 ± 5

47 ± 5

0.175 ± 0.005

unknown

¹²C¹⁶O₂

9366.4 ± 0.2

6.3 ± 0.2

0.0015 ± 1.0e-05

unknown

¹²C¹⁶O₂

9510.4 ± 0.2

4.7 ± 0.2

0.0054 ± 2.0e-04

unknown

¹²C¹⁶O₂

9621.6 ± 0.2

5.8 ± 0.2

0.002 ± 1.0e-04

unknown

¹²C¹⁶O₂

54300 ± 50

10700 ± 100

0.001

A-X

intervalence charge transfer

¹²C¹⁶O₂

unknown

70350 ± 200

9400 ± 100

11000

0.018

Δ_u ← ¹Σ⁺_g

intervalence charge transfer

¹²C¹⁶O₂

unknown

79250 ± 150

5300 ± 300

57000

0.083

¹Π_g ← ¹Σ⁺_g

intervalence charge transfer
bending

¹²C¹⁶O₂

unknown

86580 ± 150

1800 ± 300

0.45

vvs

¹Σ⁺_u ← ¹Σ⁺_g

intervalence charge transfer

¹²C¹⁶O₂

unknown

88200 ± 50

3750 ± 50

0.53

vvs

D-X

intervalence charge transfer

¹²C¹⁶O₂

unknown

92000 ± 500

8000 ± 1000

vvs

E-X

intervalence charge transfer

¹²C¹⁶O₂

unknown

Spectral parameters

Spectral range type(s): FIR, MIR, NIR, VUV
Spectral range(s): 60 - 9650 cm^-1, 50000 - 95000 cm^-1

Intensity modes and units

Reference position electronic: 92000 cm^-1
Reference position infrared: 2343.7 cm^-1

History

Versions

Release date

2021-10-01 12:55:22 UTC+0000

Version (Date)

#1 (2021-10-01 12:55:22 UTC+0000, Updated: 2024-12-23 20:11:35 UTC+0000)

History

Date	Mode	Version	Status	Comments
2021-10-01 07:31:44 UTC+0000	first import	#1	valid version

Analysis and validation

Analysis

Compilation and review of all the available publications on absorption by solid CO₂-I from the far-IR : Ron and Schnepp (1967), Lowen et al. (1989), Bini et al. (1992), Trotta (1996); the near and mid-IR: Yamada and Person (1964), Falk (1987), Sandford and Allamandola (1990), Quirico (1995), Trotta (1996), Quirico and Schmitt (1997a), Hodyss et al. (2008), Mate et al. (2009), Isokoski et al. (2013), vanBroekhuizen et al. (2013); and the VUV: Monahan and Walker (1975), Lu et al. (2008), Cruz-Diaz et al. (2014b)

Quality flag

Validation date

2021-09-07

Validators

Bernard Schmitt