SciDAC Fast Chemical Mechanism LLNL Philip Cameron-Smith Peter Connell Cathy Chuang (John Taylor) Keith Grant (Doug Rotman) NCARJean-Francois Lamarque Stacy Walters Francis Vitt ORNLDave Erickson Part of this work was performed under the auspices of the U. S. Department of Energy by the University of California, Lawrence Livermore National Laboratory under Contract No. W-7405-Eng-48.
Fast-mechanism is designed for long climate simulations, NOT atmospheric chemists. CH 4 – CO – O 3 – SO 4 mechanism 28 Species. Troposphere & Stratosphere. Unadulterated (so far). Good simulation of O 3 and SO 4 (radiative species). Over 100 years of simulation in various configurations (with and without feedback). 3 times faster than full (NMHC) mechanism. Fast = 3x CAM (ie, +200%) Full = 6x CAM (ie, +500%)
Half of chem time is advection. Tracers scale as 2-3% of CAM/tracer
Species in Fast Mechanism ( 1) O3 ( 2) O ( 3) O1D (O) ( 4) OH (HO) ( 5) HO2 ( 6) H2O2 ( 7) N ( 8) N2O ( 9) NO ( 10) NO2 ( 11) NO3 ( 12) N2O5 ( 13) HONO (HNO2) ( 14) HNO3 ( 15) HO2NO2 (HNO4) ( 16) CO ( 17) CH4 ( 18) CH2O ( 19) HCOOH (CH2O2) ( 20) CH3O2 ( 21) CH3O3 ( 22) CH3OOH (CH4O2) ( 23) CH3O2NO2 (CH3O4N) ( 24) DMS (C2H6S) ( 25) H2S ( 26) MSA (CH4O3S) ( 27) SO2 (O2S) ( 28) SULFUR6 (S)
Ozone - Ozonesondes
Ozone – Aircraft Campaigns
Ozone – Surface
OH - Spivakovsky
Chemical Lifetimes (integrated measure of OH) CH 3 CCl 3 = 4.7 years (Fast), 6.5 (Full) 6.1 +/-0.1 (Obs). CH 4 = 8.5 years (Fast), 11.8 (Full), (Obs). Prod(O 3 ) =3424 Tg(O 3 )/year (Fast) Loss (O 3 ) = 3368 Tg(O 3 )/year (Fast) Net (O 3 )= 56 Tg(O 3 )/year (Fast)
SO4 – Ocean Site Comparison.
SO4 – IMPROVE surface comparison
Sulfur Budget Tg(S) SO 2 SO 4 [H 2 O 2 ] [O 3 ] [OH] Emission68.38 Production Dry Dep Wet Dep Chem. Loss Net0.01 Mean Burden
CH2O – Aircraft Campaigns
CH 3 OOH – Aircraft Campaigns
DMS – Aircraft Campaigns
H2O2 – Aircraft Campaigns
HNO3 – Aircraft Campaigns
NOx – Aircraft Campaigns
CO – Surface samples
Fast mechanism works in stratosphere (in IMPACT, but not CAM) Compact mechanism. Own ozone field for photolysis rates. Compact mechanism. Ozone climatology for photolysis rates. Full mechanism. Own ozone field for photolysis rates.
Fast mechanism works in stratosphere (in IMPACT, but not CAM) Ratio of zonal mean ozone in July for compact chemistry runs to full chemistry run (i.e., A/C and B/C).
Future Improvements Family advection (eliminate 30% of tracer advection). Implement Fast-J photolysis and/or TUV. If necessary: Scale species (e.g. CO) to compensate for missing species. Fix Stratosphere. Add simplified NMHC chemistry.
Fast-mechanism is well positioned for AR5 CH 4 – CO – O 3 – SO 4 mechanism. Troposphere & Stratosphere. Good simulation of O 3 and SO 4 (radiative species). Over 100 years of simulation in various configurations (with and without feedback). 3 times faster than full (NMHC) mechanism. Further performance improvements under way. Fast = 3x CAM (ie, +200%) Full = 6x CAM (ie, +500%)
The End
Justification for interactive chem & aerosols Metric: Cycles spent going from specified fields to interactive chem/aerosols is more valuable than spending those cycles elsewhere. Justification areas: Climate impact. Mean climate Variability Importance to other WGs. Model validation. Air quality. Climate change detection. Online more efficient than off-line boot strapping.