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Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integratio n is Needed

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Model vs. Observations Modeled O 3 vs. Measured O 3 Cost functional measures the model- observation gap. Goal: produce an optimal state of the atmosphere using:  Model information consistent with physics/chemistry  Measurement information consistent with reality  All with errors +

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Page 1: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many

Fronts

Closer Integration is Needed

Page 2: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

P-3B

0.00

0.20

0.40

0.60

0.80

1.00

1.20

Tem

pera

ture

H2O

Win

d Sp

eed

O3

SO4

J[O

1D]

SO2

PAN

Ethe

ne

Prop

ane

CO

J[N

O2]

Etha

ne

Noy

Ethy

ne

RN

O3

Ben

zene

+ T

olue

ne

OH

AO

E

HN

O3

NO

2

NO

Cor

rela

tion

Coe

ffici

ent

R(<1KM)R(1-3KM)R(>3 KM)

Predictability – as Measured by Correlation Coefficient Met Parameters are Best

Performance decreases with altitude

< 1km

O3 predicted “better” than CO

Carmichael et al., JGR, 2003

Page 3: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Model vs. ObservationsModeled O3 vs. Measured O3

• Cost functional measures the model-observation gap.

• Goal: produce an optimal state of the atmosphere using:

Model information consistent with physics/chemistry

Measurement information consistent with reality

All with errors

+

Page 4: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Challenges in chemical data assimilation

• A large amount of variables (~100 concentrations of various species at each grid points)

– Memory shortage (check-pointing required)• Various chemical reactions (>200) coupled together

(lifetimes of different species vary from seconds to months) – Stiff differential equations

• Chemical observations are very limited, compared to meteorological data

– Information should be maximally used, with least approximation • Highly uncertain emission inventories

– Inventories often out-dated, and uncertainty not well-quantified

Page 5: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Data assimilation methods

• Simple data assimilation methods– Nudging– Optimal Interpolation (OI)– 3-Dimensional Variational data assimilation (3D-Var)– Ensembles

• Advanced data assimilation methods– 4-Dimensional Variational data assimilation (4D-Var)

• Fisher and Lary (1995), AutoChem model• CTMs with 4D-Var applications: STEM, EURAD, CHIMERE

– Kalman Filter (KF)• Many variations, e.g. Ensemble Kalman Filter (EnFK)• CTMs with KF applications: EUROS, LOTOS, MOZART,

EURAD

Page 6: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Extensive Real-Time Evaluation of Regional Forecasts – Stu McKeen

http://www.etl.noaa.gov/programs/2004/neaqs/verification/

Page 7: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Forecast Skill (One Model vs Ensemble) -- observation-based

bias corrections helpEnsemble (8 models)One CTM model

Page 8: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

4D-Var data assimilation

(old forecast)

(new)

(initial condition for NWP)

x

Page 9: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

4D-Var application with CTMs

Observations

Forward CTM model evolution

Backward adjoint model integration

Optimization

Cost function

Gradients

Update control variables

Checkpointing

Page 10: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Our Analysis Framework

MesoscaleMeteorological Model

(RAMS or MM5)MOZART Global Chemical

Transport Model

STEM Prediction Model with on-line

TUV & SCAPE

Anthropogenic & biomass burning Emissions

TOMS O3

Chemistry & TransportAnalysis

Meteorological Dependent Emissions

(biogenic, dust, sea salt)

STEM Tracer Model (classified tracers for

regional and emission types)

STEM Data-Assimilation

Model

Observations

Airmasses andtheir age & intensity

Analysis

Influence FunctionsEmission Biases/

Inversion

Page 11: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Assimilation of AIRNOW O3 surface observations for July 20, 2004Observations: circles, color coded by O3

mixing ratioSurface O3 (forecast)

Surface O3 (analysis)

Page 12: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Assimilation of elevated observations for July 20, 2004NOAA P3 flight observations Ozonesonde observations

(Rhode Island)

We are exploring these issues with a new NOAA GCP grant

Page 13: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Change of Initial O3 after Assimilation

• Date:

July 20, 2004

• Observations:

AirNow, P3-O3, Ozonesonde

• Isosurfaces of relative changes:

-20% (blue), +20% (yellow), +100% (red)

Page 14: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Effect of O3 Assimilation on Forecast

Page 15: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Courtesy John Reilly, MIT

Which species to assimilate?

Page 16: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

A Key Issue Is Which Data To Assimilate -- Example Impact of

Assimilating NOy

Leads to improved prediction of NO, NO2, PAN, and HNO3

Page 17: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Modeling the Background Error Term

• AR Models• Improved 4D-Var Results

Page 18: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

12 EDT July 20 (w/o (top) and w (bottom) assimilation)

4d-Var data assimilation results are visibly improved

when using the new AR background covariance

Observation error 8%; I.C. error 10ppbv; Initial ozone is control

Page 19: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Ensemble-based Chemical Data Assimilation

• Formulation and Challenges• Examples

Page 20: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Experimental setting of the ensemble-based data

assimilation system• 50 members, perturbed I.C., B.C., and emissions• 30% initial std, AR correlations + TESV perturbations• O3 and NO2 observations at 24 ground locations in 3 countries,

and in one vertical column. Perturbation 0.1% std, uncorrelated • Quality of analysis in a sub-domain including observation sites

Page 21: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Continued Improvement in the Forward Models are Needed: Effects of Physical

Removal Processes – which are significant sources of uncertainty

High Dry Dep Case Change in surface ozone (ppb)

With/W-o wet dep Change in column BC

Page 22: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Improving Emissions is a Top Priority: Models,

Emissions, and Observations are not

Perfect –Inverse Modeling

Page 23: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Where do we go from here?Example of Use of 3-D CFORS modeling system at TRACE-P Information Day in Hong Kong

Page 24: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Chemical Data AssimilationFeasible & necessary.Just the beginning—

more ??s than answers – we need test beds!

Important implications for measurement systems and models.

Need to grow the community.

PORT PHILLIP BAY

260 280 300 320 340 360EASTING (km)

DND

BRI

FTSPSY

PTC

MTC ALP

PTHGLS

GVD

PLP BXH

5740

5760

5780

5800

5820

5840

NORT

HING(

km)

LIGHT

MODERATE

HEAVY

AIR QUALITY FORECAST-MELBOURNE

AIR QUALITY FORECASTAIR QUALITY FORECAST--MELBOURNEMELBOURNE

NORTH EAST

HOUR

INDE

X

NORTH EAST

HOUR

INDE

X

Tomorrow will be fine and sunnyTomorrow will be fine and sunny--with moderate to heavy air pollutionwith moderate to heavy air pollution

PORT PHILLIP BAY

260 280 300 320 340 360EASTING (km)

DND

BRI

FTSPSY

PTC

MTC ALP

PTHGLS

GVD

PLP BXH

5740

5760

5780

5800

5820

5840

NORT

HING(

km)

LIGHT

MODERATE

HEAVY

AIR QUALITY FORECAST-MELBOURNE

AIR QUALITY FORECASTAIR QUALITY FORECAST--MELBOURNEMELBOURNE

PORT PHILLIP BAY

260 280 300 320 340 360EASTING (km)

DND

BRI

FTSPSY

PORT PHILLIP BAY

260 280 300 320 340 360EASTING (km)

DND

BRI

FTSPSY

PTC

MTC ALP

PTHGLS

GVD

PLP BXH

5740

5760

5780

5800

5820

5840

NORT

HING(

km)

LIGHT

MODERATE

HEAVY

AIR QUALITY FORECAST-MELBOURNE

AIR QUALITY FORECASTAIR QUALITY FORECAST--MELBOURNEMELBOURNE

NORTH EAST

HOUR

INDE

X

NORTH EAST

HOUR

INDE

X NORTH EAST

HOUR

INDE

X

NORTH EAST

HOUR

INDE

X

Tomorrow will be fine and sunnyTomorrow will be fine and sunny--with moderate to heavy air pollutionwith moderate to heavy air pollution

Page 25: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed
Page 26: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed
Page 27: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed

Objectives:1. To ensure accurate, comprehensive global

observations of key atmospheric gases and aerosols;

2. To establish a system for integrating ground-based, in situ and satellite observations using atmospheric models;

3. To make the integrated observations accessible to users.

[email protected]@esa.int

An international process:

Panel of 19 experts from 12 countries and independent reviewers from 7 countries.

Integrated Global Atmospheric Chemistry Observation (IGACO) System

SatelliteObservations

Aircraft

Ground-based

IGACO System

Links to:

Space agencies, WCRP, GCOS, IGBP, IGOS themes

Implemented by WMOSee Overleaf

NO2

Products

Page 28: Atmospheric Chemistry Measurement and Modeling Capabilities are Advancing on Many Fronts Closer Integration is Needed