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1 Conventional Combustion Exit Presentation Megan Karalus Mentor: Robyn Thomas Technical Adviser: Priyank Saxena Group Manager: Anthony Batakis Functional Manager: Andy Luts September 7 th , 2012

Conventional Combustion Exit Presentation

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Page 1: Conventional Combustion Exit Presentation

1

Conventional Combustion Exit Presentation

Megan Karalus Mentor: Robyn Thomas

Technical Adviser: Priyank Saxena Group Manager: Anthony Batakis Functional Manager: Andy Luts

September 7th, 2012

Page 2: Conventional Combustion Exit Presentation

2

Agenda

•  Carbon Formation Investigation and Mitigation

–  Broad Goal: Literature Review, Modeling and Analysis •  Conclusions and Recommendations •  Acknowledgements •  Summer in San Diego

Page 3: Conventional Combustion Exit Presentation

3

Brief History….

•  Current production injector •  No carbon deposition •  Lacks mechanical robustness

Cutback

Carbon deposition

with natural gas

•  New proposed design •  Carbon deposits on the shroud

face.

Fuel

2020 Outer Air Swirler

Inner Air Swirler

Shroud Face

Conventional Dual Fuel Injectors

Page 4: Conventional Combustion Exit Presentation

4

Brief History…

Cutback

2020

Previous Natural Gas Paint Test in Mars 100 Engine

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Project Outline

•  Broad Goal: develop knowledge base and methodology for troubleshooting carbon buildup on other injector designs. –  Theory and Literature Review –  Chemkin Modeling (equilibrium & detailed chemistry) –  CFD Analysis

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Carbon Types

Analogy to Snow and Frost Formation “Gas phase nucleation yields snow [carbon black] and

heterogeneous nucleation on a substrate and subsequent growth gives frost [pyrocarbon]” (Bourrat)

Broad Goal: Theory / Chemkin / CFD

Carbon Black / Soot Pyrocarbon

Page 7: Conventional Combustion Exit Presentation

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Carbon Black

Formation

Fuel

Crucial for Soot -> Pyrene

Controlling Parameters

•  Pressure •  Temperature •  Residence Time •  Higher Hydrocarbons •  Equivalence Ratio

Broad Goal: Theory / Chemkin / CFD

Page 8: Conventional Combustion Exit Presentation

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Pyrocarbon

Formation and Control

1. More likely than we think? "It is only in very exceptional circumstances that the interaction

of a hydrocarbon with a metal surface does not lead to carbon deposition.” [Bond 1997]

2. Forms at lower temperatures and or pressures than carbon black. “…a pyrocarbon should be formed at a lower T and (or) P than predicted by

classical homogeneous nucleation, which gives rise to the formation of carbon blacks.”

[Delhae 2001]

3. Surface plays a key role. "It has been shown that the substrate plays a role in the first pyrocarbon layers

from a physical (roughness, curvature and surface energy) and a chemical (nucleation sites) point of view.”

[Delhae 2001]

Broad Goal: Theory / Chemkin / CFD

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Chemkin Outline

1.  Equilibrium 2.  Perfectly Stirred Reactor 3.  Opposed Flow Diffusion Flame

Broad Goal: Theory / Chemkin / CFD

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1. Equilibrium

Constant mixture temperature and pressure

Temperature and mixing near the shroud are controllable parameters in design of injectors.

What we learn…

•  Temperature threshold for presence of carbon as a function of equivalence ratio.

•  Carbon presence requires rich mixtures

Broad Goal: Theory / Chemkin / CFD

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2. PSR - Setup

Perfectly Stirred Reactor (PSR) •  Parameter Study Method

–  Hold constant Equivalence Ratio and Pressure.

–  Vary Temperature and Residence Time.

PSR T, P, t

Fuel/Air

Φ

Products

Chemical Mechanism

Broad Goal: Theory / Chemkin / CFD

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2. PSR - Results

Equivalence Ratio = 2, P=250 psia What we learn… •  Time allowed for reaction

can be important (residence time).

•  Minimum temperature threshold as a function of residence time for carbon.

Broad Goal: Theory / Chemkin / CFD

Mol

e Fr

actio

n P

yren

e

Page 13: Conventional Combustion Exit Presentation

13

3. Opposed Flow Diffusion Flame

•  Transport can be important. •  Pyrene is produced at

higher temperatures but can exist at lower temperatures in rich mixtures.

0

500

1000

1500

2000

2500

3000

3500

0 0.2 0.4 0.6 0.8 1

Distance (cm)

Tem

pera

ture

(F)

-2.0E-12

-1.5E-12

-1.0E-12

-5.0E-13

0.0E+00

5.0E-13

1.0E-12

1.5E-12

2.0E-12

2.5E-12

Rat

e of

Pro

duct

ion

(mol

e/cm

3-s)

Temperature (F) ROP-A4

0

500

1000

1500

2000

2500

3000

3500

0 0.2 0.4 0.6 0.8 1

Distance (cm)

Tem

pera

ture

(F)

0.0E+00

5.0E-11

1.0E-10

1.5E-10

2.0E-10

2.5E-10

3.0E-10

3.5E-10

4.0E-10

4.5E-10

5.0E-10

Mol

e Fr

actio

n A

4

Temperature (F) Mole Fraction A4

What we learn…

Production of Pyrene Location of Pyrene

Broad Goal: Theory / Chemkin / CFD

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3. Opposed Flow Diffusion Flame

•  Transport can be important. •  Carbon Black is formed

wherever Pyrene is present.

0

500

1000

1500

2000

2500

3000

3500

0 0.2 0.4 0.6 0.8 1

Distance (cm)

Tem

pera

ture

(F)

0.0E+00

5.0E-11

1.0E-10

1.5E-10

2.0E-10

2.5E-10

3.0E-10

3.5E-10

4.0E-10

4.5E-10

5.0E-10

Mol

e Fr

actio

n A

4

Temperature (F) Mole Fraction A4

0

500

1000

1500

2000

2500

3000

3500

0 0.2 0.4 0.6 0.8 1

Distance (cm)

Tem

pera

ture

(F)

0

2E-16

4E-16

6E-16

8E-16

1E-15

1.2E-15

1.4E-15

1.6E-15

1.8E-15

Rat

e of

Pro

duct

ion

of C

B

(g/c

m3-

s)

Temperature (F) ROP CB

What we learn… Broad Goal: Theory / Detailed Chemistry / CFD

Location of Pyrene Carbon Black Production

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3. Opposed Flow Diffusion Flame

•  Transport can be important. •  Pyrene is produced at

higher temperatures but can exist at lower temperatures in rich mixtures.

•  Soot is formed wherever Pyrene is present.

•  CO is a good ‘marker’ for the presence of Pyrene and therefore Carbon Black – useful for CFD analysis.

What we learn… Broad Goal: Theory / Detailed Chemistry / CFD

Co-Location of Pyrene and CO

0.0E+00

5.0E-03

1.0E-02

1.5E-02

2.0E-02

2.5E-02

3.0E-02

3.5E-02

4.0E-02

4.5E-02

5.0E-02

0 0.2 0.4 0.6 0.8 1

Distance (cm)

Mol

e Fr

actio

n C

O

0.0E+00

5.0E-11

1.0E-10

1.5E-10

2.0E-10

2.5E-10

3.0E-10

3.5E-10

4.0E-10

4.5E-10

5.0E-10

Mol

e Fr

actio

n A

4

Mole Fraction CO Mole Fraction A4

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CFD Outline

Assumption #1

Carbon Black (soot formation) is responsible for carbon deposition.

Assumption #2 Pyrocarbon is responsible for carbon deposition

(i.e. the surface participates)

Broad Goal: Theory / Chemkin / CFD

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CFD: Soot

Assumption #1

Carbon Black (soot formation) is responsible for carbon deposition.

Near Shroud

1.  Formed in recirculation zone near shroud (i.e. PSR)?

2.  Formed in flame and transported to shroud?

Broad Goal: Theory / Chemkin / CFD

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CFD: Soot

"   Formed in recirculation zone near shroud (i.e. PSR)?

2. Formed in flame and transported to shroud?

Assumption #1

Carbon Black (soot formation) is responsible for carbon deposition.

Red is all greater than 5% CO Max

2020 Shroud

Broad Goal: Theory / Chemkin / CFD

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CFD: Soot

"   Formed in recirculation zone near shroud (i.e. PSR)?

"   Formed in flame and transported to shroud?

Broad Goal: Theory / Detailed Chemistry / CFD / Experiments

Assumption #1

Carbon Black (soot formation) is responsible for carbon deposition.

Red is all greater than 5% CO Max

2020 Shroud

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20

CFD: Pyrocarbon

Assumption #2 Pyrocarbon is responsible for carbon deposition

(i.e. the surface participates)

•  On equilibrium model, plot conditions near shroud determined from CFD and paint tests

Injector Shroud Inner Air Swirler

Broad Goal: Theory / Chemkin / CFD

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Conclusions and Recommendations

•  Rich mixtures are required for carbon formation (soot or pyrocarbon)

•  Small amounts of higher hydrocarbons in the fuel will increase the likely hood of soot formation

•  Increased pressure allows formation of soot precursors at lower pressures and shorter residence times.

•  The nucleation of soot is not temperature dependent.

•  CO is a good marker species for soot in CFD models.

•  Carbon deposition is most likely due to ‘pyrocarbon’ (the surface participates)

•  Apply equilibrium model in conjunction with CFD as a potential pass/fail design tool for other injectors.

•  Determine if paint application is influencing test results (SI Rig test)

Conclusions Recommendations

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Acknowledgements

•  Tony Batakis •  Robyn Thomas •  Priyank Saxena •  Ryan Youtsey •  Dan Golden •  Stuart Greenwood •  Mike Lane •  Emily Almaraz •  Jeff Detweiler •  Scott Lindner

•  Paul Cramer •  Barry Raghunathan •  Jack Johnson •  Will Rhodes •  Charmaine Gary •  Denise Rodriguez •  Andy Luts •  Tim Bridgman •  Rotations •  Interns