A Lagrangian view of the Stratospheric Mixing
Simulations with CLaMS
CLaMS – Chemical Lagrangian Model of the Stratosphere
P. Konopka et al.
P.Konopka@fz-juelich.de
http://www.fz-juelich.de/icg/icg-i/www export/p.konopka
Research Centre J ¨ulich, ICG-I: Stratosphere, Germany
CLaMS-Model
CLaMS - Lagrangian Chemistry Transport Model Potential temperature as vertical coordinate
Horizontal and vertical velocities from meteor. winds (ECMWF) and/or a radiation scheme Lagrangian mixing
Full stratospheric chemistry
Lagrangian particle sedimentation scheme parallelized code (JUMP)
McKenna et al., JGR, 2002, Konopka et al., JGR, 2004, Grooß et al., 2005, ACP TRAJECTORIES
MIXING CHEMISTRY
SEDIMENTATION
Lagrange versus Euler
Lagrange (irregular grid)
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r(t)
mixing (exchange of mass) is under control
Euler
(regular grid)
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@ @ @ @ A A A A A
A A A A A
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A A A A A
B B B B B
B B B B B
B B B B B
B B B B B
C C C
C C C
C C C
C C C
C C C
C C C
C C C
C C C
C C C
C C CD D
D D
D D
D D
D D
D D
D D
D D
D D
D D E E E E
E E E E
E E E E
E E E E
E E E E
E E E E
E E E E
E E E E
E E E E
E E E E
F F F
F F F
F F F
F F F
F F F
F F F
F F F
F F F
F F F
F F F G G G
G G G
G G G
G G G
G G G
G G G
G G G
G G G
H H H
H H H
H H H
H H H
H H H
H H H
H H H
H H H I I I I
I I I I
I I I I
I I I I
I I I I
I I I I
I I I I
J J J J
J J J J
J J J J
J J J J
J J J J
J J J J
J J J J
K K
K K
K K
K K
K K
K K
K K
K KLLLLLLLL M M M M
M M M M
M M M M
M M M M
M M M M
M M M M
M M M M
M M M M
N N N
N N N
N N N
N N N
N N N
N N N
N N N
N N N O O O O
O O O O
O O O O
O O O O
O O O O
O O O O
O O O O
P P P P
P P P P
P P P P
P P P P
P P P P
P P P P
P P P P Q Q Q Q
Q Q Q Q
Q Q Q Q
Q Q Q Q
R R R R
R R R R
R R R R
R R R R
S S S S S
S S S S S
S S S S S
S S S S S
S S S S S
S S S S S
S S S S S
S S S S S
T T T T
T T T T
T T T T
T T T T
T T T T
T T T T
T T T T
T T T T U U U U U
U U U U U
U U U U U
U U U U U
U U U U U
U U U U U
U U U U U
V V V V
V V V V
V V V V
V V V V
V V V V
V V V V
V V V V W W W W
W W W W
W W W W
W W W W
W W W W
W W W W
X X X X
X X X X
X X X X
X X X X
X X X X
X X X X Y Y Y Y Y
Y Y Y Y Y
Y Y Y Y Y
Z Z Z Z Z
Z Z Z Z Z
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mixing is determined
Mixing in CLaMS
Large-scale wind
Small-scale deformations
Filamentation
Mixing
(irreversibility)
Grid Adaptation ⇒ Mixing
A C B
quasiuniform distribution of air parcels
Delaunay triangulation ⇒ next neighbors
sheared flow
∆t = 6− 24 hours
A C B
D
grid adaptation =
regridding of the deformed grid
⇒ new air parcels
⇒ interpolations (num. diffusion)
⇒ mixing
Grid Adaptation ⇒ Mixing
A C B
quasiuniform distribution of air parcels
Delaunay triangulation ⇒ next neighbors
sheared flow
∆t = 6 −24 hours
A C B
D
grid adaptation =
regridding of the deformed grid
⇒ new air parcels
⇒ interpolations (num. diffusion)
⇒ mixing
Grid Adaptation ⇒ Mixing
A C B
quasiuniform distribution of air parcels
Delaunay triangulation ⇒ next neighbors
sheared flow
∆t = 6 − 24 hours
A C B
D
grid adaptation =
regridding of the deformed grid
⇒ new air parcels
⇒ interpolations (num. diffusion)
Lyapunov Exponent λ
r0
t=t0
Consider an air parcel sur- rounded by a small circle of ra- dius r0.
t=t + t r r
+
−
0
After a time ∆t and for sufficiently small values of r0, the circle is deformed into an ellipse with minor and major axes r− and r+
Definition: (Lyapunov exponent)
λ± = ± 1
∆t ln r± r0
for sufficiently small ∆t and r0
Incompressible flows ⇒ (r02 = r−r+) ⇒ λ− = λ+
Lyapunov Exponent λ
r0
t=t0
Consider an air parcel sur- rounded by a small circle of ra- dius r0.
t=t + t r r
+
−
0
After a time ∆t and for sufficiently small values of r0, the circle is deformed into an ellipse with minor and major axes r− and r+
Definition: (Lyapunov exponent)
λ± = ± 1
∆t ln r± r0
for sufficiently small ∆t and r0 2
2d-CLaMS: Dynamically Adaptive Grid
Before the advection step
A C B
Determine nearest neighbors (e.g. for point A), r0 - mean distance between air parcels
Set the critical Lyapunov exponent λc and the time step ∆t (free parameter) Define rc±
r±c = r0 exp±λc∆t After the advection step
A C B
D
If r > r+c , then a new grid point D is inserted midway between A and B (insertion)
If r < rc−, then grid points A and C are removed and a new grid point is intro- duced midway between the positions of A and C (merging)
2d-CLaMS: Dynamically Adaptive Grid
Before the advection step
A C B
Determine nearest neighbors (e.g. for point A), r0 - mean distance between air parcels
Set the critical Lyapunov exponent λc and the time step ∆t (free parameter) Define rc±
After the advection step
A C B
D
If r > r+c , then a new grid point D is inserted midway between A and B (insertion)
If r < rc−, then grid points A and C are removed and a new grid point is intro- duced midway between the positions of
Mixing in the vicinity of the subtropical jet
Subtropical jet
over Himalayas
Mixing in the vicinity of the subtropical jet
Subtropical jet over Himalayas
Strong
deformations ...
Mixing in the vicinity of the subtropical jet
Subtropical jet over Himalayas
... and mixing !
Critical deformation
Mixing in CLaMS is controlled by:
1. critical deformation γ c or critical eccentricity of the deformation ellipse r + c /r − c
γ c = λ c ∆t = 0.5 ln r r
+cc−
2. horizontal, r 0 (2d) and vertical resolution, ∆z (3d)
Comparison with experiment ⇒ mixing parameters
Mixing versus CRISTA-1 observations
CRISTA observations
(November, 10, 1994)
Mixing versus CRISTA-1 observations
CRISTA observations (November, 10, 1994)
CLaMS-2d
no mixing
Mixing versus CRISTA-1 observations
CRISTA observations (November, 10, 1994)
CLaMS-2d
mixing too strong
Mixing versus CRISTA-1 observations
CRISTA observations (November, 10, 1994)
CLaMS-2d
optimal mixing
N 2 O variability in terms of PDFs
Synoptic map of N2O from CRISTA-1, 4-6 Nov 1994 at θ = 700 K.
−200 −100 0 100 200
∆ N2O [ppbv]
0.0001 0.0010 0.0100 0.1000
CRISTA observations Gaussian fit Exponential tails, p=0.63
CRISTA observations Gaussian fit
Exponential tails, p=0.63
PDF – probability density function of N2O differences between neighboring observations with 150< r <250 km
⇒ “fat” tails inidicate filaments and 2d-turbulence
N 2 O variability in terms of PDFs
−200 −100 0 100 200
∆ N2O [ppbv]
0.0001 0.0010 0.0100 0.1000
CRISTA observations Gaussian fit Exponential tails, p=0.63
CRISTA observations Gaussian fit
Exponential tails, p=0.63
PDF – probability density function of N2O differences between neighboring observations with 150< r <250 km
CLaMS versus CRISTA PDFs
−300 −200 −100 0 100 200 300
∆ N2O [ppbv]
0.0001 0.0010 0.0100 0.1000
CRISTA observations
reduced
satellite optimized in−situ optimized
enhanced
KASIMA
(Khosrawi et al., 2005, ACP)
Optimal mixing (in situ observation)
Spatial variability of the simulated time series γ:
γ ≈ ∆theor
∆exp
, ∆ =
n
X
i=1
|f(ti+1) −f(ti)|
09:00 10:00 11:00 12:00 13:00 14:00 15:00 time [UTC]
0.6 0.8 1.0 1.2 1.4 1.6
CH4 [ppm]
0.6 0.8 1.0 1.2 1.4 1.6
CH4 [ppm]
γ > 1
no mixing
09:00 10:00 11:00 12:00 13:00 14:00 15:00 time [UTC]
0.6 0.8 1.0 1.2 1.4 1.6
0.6 0.8 1.0 1.2 1.4 1.6
γ ∼ 1
Exp, ARGUS CLaMS
Exp, ARGUS CLaMS
optimal mixing
09:00 10:00 11:00 12:00 13:00 14:00 15:00 time [UTC]
0.6 0.8 1.0 1.2 1.4 1.6
0.6 0.8 1.0 1.2 1.4 1.6
γ < 1
mixing too strong
Optimal mixing (in situ observation)
Spatial variability of the simulated time series γ:
γ ≈ ∆theor
∆exp
, ∆ =
n
X
i=1
|f(ti+1) −f(ti)|
09:00 10:00 11:00 12:00 13:00 14:00 15:00 time [UTC]
0.6 0.8 1.0 1.2 1.4 1.6
CH4 [ppm]
0.6 0.8 1.0 1.2 1.4 1.6
CH4 [ppm]
γ > 1
no mixing
09:00 10:00 11:00 12:00 13:00 14:00 15:00 time [UTC]
0.6 0.8 1.0 1.2 1.4 1.6
0.6 0.8 1.0 1.2 1.4 1.6
γ ∼ 1
Exp, ARGUS CLaMS
Exp, ARGUS CLaMS
optimal mixing
09:00 10:00 11:00 12:00 13:00 14:00 15:00 time [UTC]
0.6 0.8 1.0 1.2 1.4 1.6
0.6 0.8 1.0 1.2 1.4 1.6
γ < 1
mixing too strong
Optimal mixing (tracer correlations)
Mean deviation from the CH4/Halon-1211 correlation
2 = 1 m
m
X
i=1
2i 2i = 1 − fitheor fiexp
!2
+ 1 − githeor giexp
!2
no mixing
optimal mixing
mixing too strong
Optimal mixing (tracer correlations)
Mean deviation from the CH4/Halon-1211 correlation
2 = 1 m
m
X
i=1
2i 2i = 1 − fitheor fiexp
!2
+ 1 − githeor giexp
!2
no mixing optimal mixing mixing too strong
= 0 means a perfect agreement between CLaMS and observations.
Optimal mixing
1
Spatial variability γ 10
Deviation from H1211/CH4 correlation ε [%] 0.5 0.75 1.0 1.5 2.0 ∞λc∆t=
300 km 200 km
150 km 100 km excess
mixing no mixing
Optimal mixing: γ = 1, = 0
Conclusions:
Mixing improves tracer transport only for r0 < 300 km
Best agreement with satellite and
in situ observations for:
γc = 0.8 (satellite). . .1.5 (in situ) γc=λc∆t - critical deformation
Optimized aspect ratio: α ≈ 250 Konopka et al. 2004, JGR
Per day ≈ 10% of air parcels are mixed. If mixinig occurs:
How homogeneous and isotropic is strat. mixing?
CLaMS v. Exp. Res. r 0 [km] Crit. def. γ c Ecc. r + c /r − c
2d v. CRISTA 200 0.8 5
2d v. in situ 40 1.2 11
3d v. in situ 80 1.5 20
anisotropy ∼ (r + c /r c
− ) 2
How homogeneous and isotropic is strat. mixing?
mixing inhomogeneous in space
How homogeneous and isotropic is strat. mixing?
mixing inhomogeneous in time
0.0 0.2 0.4 0.6 0.8 1.0 1.2
Deformation param. γ
γc=0.8
0.5 1.0 1.5 2.0 2.5
D−× 104 [m2 /s]
Deform. param., γ=λ∆
t − Diffusion coef., D
Deform. param., γ=λ∆t Diffusion coef., D−
80 70 60 50 40 30
Equivalent Latitude [deg S]
80 70 60 50 40 30
Equivalent Latitude [deg S]
22.10.94 01.11.94 10.11.94
7.8
1.5 2.2 2.9 3.6 4.3 5.0 5.7 6.4 7.1 7.8 9.5
<D> [103 m2/s]
Formation of fragments A, B
Strong mixing
Moderate and weak mixing
Vortex edge
Permeability of the vortex edge
400 600 800 1000 1200
Pot. Temperature [K]
400 600 800 1000 1200
Pot. Temperature [K]
01.01.03 01.03.03 01.05.03
time
100.00
0.00 10.00 20.00 30.00 40.00 50.00 60.00 70.00 80.00 90.00 100.00 Vortex Air
mW1 MW mW2 mW3 FW
1.5
1.5
1.5 1.5
1.5
Vortex Air=50% EQLAT>70 EQLAT>65 EQLAT>75
Vortex Air=50%
EQLAT>70 EQLAT>65 EQLAT>75
Despite a strong activity of planetary waves in winter 2002-2003, the vortex between θ =450
Permeability of the vortex edge
85 80 75 70 65 60
Equivalent Latitude [deg S]
400 500 600 700 800 900 1000
Pot. Temperature [K]
85 80 75 70 65 60
Equivalent Latitude [deg S]
400 500 600 700 800 900 1000
Pot. Temperature [K]
1.50
0.25 0.38 0.50 0.62 0.75 0.88 1.00 1.12 1.25 1.38 1.50 CH4 [ppmv]
75
75
98 98
Well-isolated vortex remnant 5 weeks after “vortex split” in September 2002, “frozen-in”
ozone loss, (Konopka et al. 2005, JAS)
Long-lived vortex remnants
θ = 450K (≈ 18 km)
⇐ Vortex remnants on April 29, 2000 about 40 days after the vortex breakup.
These remnants show a strong vertical coherence and correlation with PV.
Long-lived vortex remnants
θ = 450K (≈ 18 km) θ = 585K (≈ 24 km)
Vortex remnants on May 22, 1997, about 12 days after the vortex breakup. The remnants are trapped in the “solid body” summer circulation (Konopka et al., ACP, 2003)
Mixing ⇒ chlorine deactivation
Chlorine deactivation = formation of ClONO2
ClO +NO2 → ClONO2
North pole mid−latitude air
vortex air ClO
NOx weak mixing
Question:
What is the mechanism of the chlorine deactiva- tion ?:
1. mixing of the vortex ClO with NOx-rich mid-latitude air
2. in situ NOx production due to the photolyt- ical decomposition of HNO3
Mixing ⇒ chlorine deactivation
ClONO2 collar at θ = 450 K on March 11, 2000 (CLaMS-2d)
Optimal mixing
Mixing ⇒ chlorine deactivation
ClONO2 collar at θ = 450 K on March 11, 2000 (CLaMS-2d)
Optimal mixing Pure advection
in situ chemistry in air parcels ⇒
Impact of mixing on O 3 chemistry
Ozone depletion at 450 K on 29.04.2000
no mixing adjusted mixing mixing too strong
Ozone loss: Impact on mid-latitudes
01.03.2000 01.04.2000 01.05.2000 time
−10
−5 0 5 10 15 20
Mean O3 loss [%]
30<lat<90 N
adjusted mixing − D
=1.1 10 −
m 3
/s /s 22 2 m m 5 4 =1.1 10 =2.6 10 − − mixing too large − D − D
/s 2 m 5 =4.2 10 − − D
/s =0 y , Br y strong denitrification Cl
adjusted mixing − D−=1.1 103 m2/s mixing too large − D−=2.6 104 m2/s − D−=1.1 105 m2/s − D−=4.2 105 m2/s strong denitrification
Ozone loss: Impact on mid-latitudes
01.03.2000 01.04.2000 01.05.2000 time
−10
−5 0 5 10 15 20
Mean O3 loss [%]
30<lat<90 N
adjusted mixing − D
=1.1 10 −
m 3
/s /s 22 2 m m 5 4 =1.1 10 =2.6 10 − − mixing too large − D − D
/s 2 m 5 =4.2 10 − − D
/s =0 y , Br y strong denitrification Cl
adjusted mixing − D−=1.1 103 m2/s mixing too large − D−=2.6 104 m2/s − D−=1.1 105 m2/s − D−=4.2 105 m2/s strong denitrification
Cly, Bry=0
Ozone loss: Impact on mid-latitudes
01.03.2000 01.04.2000 01.05.2000 time
−10
−5 0 5 10 15 20
Mean O3 loss [%]
30<lat<90 N
adjusted mixing − D
=1.1 10 −
m 3
/s /s 22 2 m m 5 4 =1.1 10 =2.6 10 − − mixing too large − D − D
/s 2 m 5 =4.2 10 − − D
/s =0 y , Br y strong denitrification Cl
adjusted mixing − D−=1.1 103 m2/s mixing too large − D−=2.6 104 m2/s − D−=1.1 105 m2/s − D−=4.2 105 m2/s strong denitrification
Ozone loss: Impact on mid-latitudes
01.03.2000 01.04.2000 01.05.2000 time
−10
−5 0 5 10 15 20
Mean O3 loss [%]
30<lat<90 N
adjusted mixing − D
=1.1 10 −
m 3
/s /s 22 2 m m 5 4 =1.1 10 =2.6 10 − − mixing too large − D − D
/s 2 m 5 =4.2 10 − − D
/s =0 y , Br y strong denitrification Cl
adjusted mixing − D−=1.1 103 m2/s mixing too large − D−=2.6 104 m2/s − D−=1.1 105 m2/s − D−=4.2 105 m2/s strong denitrification
Cly, Bry=0
Ozone loss: Impact on mid-latitudes
01.03.2000 01.04.2000 01.05.2000 time
−10
−5 0 5 10 15 20
Mean O3 loss [%]
O3 destruction within the vortex
O3 destr. in vortex remnants (ClOx)
Dilution of depleted vortex remnants
30<lat<90 N
adjusted mixing − D
=1.1 10 −
m 3
/s /s 22 2 m m 5 4 =1.1 10 =2.6 10 − − mixing too large − D − D
/s 2 m 5 =4.2 10 − − D
/s =0 y , Br y strong denitrification Cl
adjusted mixing − D−=1.1 103 m2/s mixing too large − D−=2.6 104 m2/s − D−=1.1 105 m2/s − D−=4.2 105 m2/s strong denitrification
Conclusions
CLaMS - Lagrangian 3d-CTM:
trajectories (reversibel) + mixing (irreversibel) + chemistry 1. mixing driven by large-scale deformations
2. model validation:
polar stratosphere und extratropical UT/LS region Examples:
Permeability of the vortex edge
layerwise mixing into the vortex triggered by breaking planetary waves
long-living vortex remnants with frozen-in ozone loss (impact on the mid-latitudes) Summer circulation ⇒ “solid body rotation” ⇒ weak mixing
chlorine deactivation in the well-isolated vortex driven by in situ chemistry
Acknowledgments:
CLaMS group:
Danny McKenna (now at NCAR, Boulder),
Rolf Müller, Jens-Uwe Grooß, Gebhard Günther, Paul Konopka, Hildegard-Maria Steinhorst, Stephan Bausch, Carsten Lemmen, Verena Cals, Nicole Thomas, Jürgen Ankenbrand, Reimar Bauer Modeling support:
Yvan Orsolini (NILU, Oslo), Glenn Carver (University of Cambridge), Ken Carslaw (University of Leeds), Yasuhiro Sasano (NIES, Tsukuba), Richard Swinbank (UKMO), Joanna Haigh (Imperial College, London)
Experimental data:
CRISTA-Team:
Martin Riese, Dirk Offermann, Reinhold Spang, Volker Küll (University of Wuppertal) ...
SOLVE-THESEO-Team:
James Elkins (University of Colorado), Hans-Jürg Jost (NASA, Moffett Field), Geoffrey Toon (JPL, Pasadena), Andreas Engel, Ulrich Schmidt (University of
Transport of ozone and CO during SPURT
Alt [km]
18.0
15.5
13.0
10.5
8.0
Equator North Pole
TROPICS
MID−LATITUDES
POLAR REGION STRATOSPHERE
500 K
290 K
radiation scheme Vertical velocities from
?
OK
Configuration of CLaMS
for 2 years simulation
Transport of ozone and CO during SPURT
Alt [km]
18.0
15.5
13.0
10.5
8.0
TROPICS
MID−LATITUDES
STRATOSPHERE 500 K
290 K
radiation scheme Vertical velocities from
?
OK
Configuration of CLaMS
for 2 years simulation
Seasonal cycle of ozone
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
1000.
0.
100.
200.
300.
400.
500.
600.
700.
800.
900.
1000.
O3 [ppmv]
Stratosphere
Troposphere
Fall
Zonally averaged ozone
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
Winter
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
Spring
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
Summer
STT-
Transport
Seasonal cycle of ozone
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
1000.
0.
100.
200.
300.
400.
500.
600.
700.
800.
900.
1000.
O3 [ppmv]
Stratosphere
Troposphere
Fall
Zonally averaged ozone
Mean tropopause
Subtropical jet
(transport barrier)
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
Winter
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
Spring
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
Summer
STT-
Transport
Seasonal cycle of ozone
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
1000.
0.
100.
200.
300.
400.
500.
600.
700.
800.
900.
1000.
O3 [ppmv]
Stratosphere
Troposphere
Fall
320 340 360 380 400 420
Pot. Temperature [K]
320 340 360 380 400 420
Pot. Temperature [K]
Winter
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
Spring
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
20 40 60 80
Equivalent Latitude [deg N]
320 340 360 380 400 420
Pot. Temperature [K]
Summer