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Co-Optimization of Fuels and Engines (Co-Optima) --Simulation ...

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! Co-Optimization of Fuels and Engines (Co-Optima) – Simulation Toolkit Team This presentation does not contain any proprietary, confidential, or otherwise restricted information #$%&% '( ')*+,-./ ! 0( 012/ 3 !" $%&&'()*+(, - ." !" /01%&02, 3 4" 5&+6*, 7 8" .+0%9%2%:, ; 5" <%=%>?, @ 8" A?B?:?'(, @ C" C%:, ; D" 4%E, ; F" D%( !%E, ; 8" G%*?&2, - %(0 4" GH'*?2'0?2 I I" <%1&?(=? <'9?&E+&? F%J+(%: <%K+&%*+&L ;" M&)+((? F%J+(%: <%K+&%*+&L -" <+2 M:%E+2 F%J+(%: <%K+&%*+&L 3" A%N 4'0)? F%J+(%: <%K+&%*+&L 7" F%J+(%: 4?(?1%K:? /(?&)L <%K+&%*+&L @" O%(0'% F%J+(%: <%K+&%*+&'?2 $+PAQJE% !A/ R%(%)?E?(* S?%E T .?9'( O*+&N %(0 56&Q&??* O'()H UDSAV M:'='% <'(0%6?& UW/SAV June 9 th , 2016
Transcript

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Co-Optimization of Fuels and Engines (Co-Optima) – Simulation Toolkit Team

This presentation does not contain any proprietary, confidential, or otherwise restricted information

#$%&%"

'("')*+,-./!"0("012/3"!"#$%&&'()*+(,-#"."#!"#/01%&02,3#4"#5&+6*,7#8"#.+0%9%2%:,;#5"#<%=%>?,@#8"#A?B?:?'(,@#C"#C%:,;#D"#4%E,;#F"#D%(#!%E,;#8"#G%*?&2,-#%(0#4"#GH'*?2'0?2I#

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June 9th, 2016

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Part I: Relevance, Collaborations and Approach

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Overview

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Simulation Toolkit Team Relevance

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AQJE%#)?(?&%*?0#0%*%#%(0#=+(2*&%'(*2#

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Approach: Assemble a highly skilled team of DOE VTO researchers

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Approach: Leverage existing VTO software and expertise spanning the simulation space

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Approach: Build a shared community around computing and data to accelerate research

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•! 7\.#](*?:#h?+(#$CY2#

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Approach: Build a shared community around computing and data to accelerate research

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Task approach and inter-team collaborations

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Fuel LowGHG

Engine

ASSERT

Fuel

LowGHG Fuel Engine

!%"

/-i#

$&'J=%:#C+'(*T#C=#n#3I"7#K%&#S=#n#7;\#.#

Task G.1.1 - Fuel Blending Model for Simulation Inputs

•! ^1:-<"R+0?:#%(L#(?1#%(0#?a'2J()#B6?:#K:?(02*+=N2#=+(2'0?&?0#KL#$+PAQJE%#'(#*H?#26'*?#+B#DSA#2+f1%&?#*++:2#B+&#=+EK62J+(#%(0#?()'(?#%(%:L2'2#

•! OAA61:)N<""$&?%*?,#*?2*#%(0#9%:'0%*?#*H?&E+QHL2'=%:#%(0#=H?E'=%:#N'(?J=#'(Q6*#?2JE%J+(#%(0#)?(?&%J+(#*?=H('o6?2"##

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M0X62*#26&&+)%*?#=+EQ+2'J+(#+&#N?L#&?%=J+(#&%*?2#*+#=%Q*6&?T#

!!"

Task G.1.1 - Fuel Blending Model for Simulation Inputs

•! *+Y"):A:XE-ES+9":,;":,:-.9+9<""–! D'&*6%:#*?2*2#*+#E%Q#=H%()?2#'(#*H?&E+0L(%E'=,#*&%(2Q+&*,#N'(?J=#

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–! $&?%J+(#+B#9'&*6%:#B6?:2#1'*H#+QJE'>?0#Q&+Q?&J?2#

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–! Y2?#2'E6:%J+(2#*+#%(21?&#d1H%*#Q&+Q?&*L#&%()?#0+?2#%(#?()'(?2#1%(*re#

•! C1_KAS2:"b2A:)8<"–! $&?%*?2#*H?#(?=?22%&L#*++:2#*+#*?2*#%(0#9%:'0%*?#*H?#$?(*&%:#Z6?:#C&+Q?&*L#

HLQ+*H?2'2#%(0#*H?#$+PAQJE%#R?&'*#Z6(=J+(#2?(2'J9'*L#=+?c='?(*2#

!3"

Task G.1.2 - Support Small Volume Fuel Testing

•! ^1:-<"4?%=H#*H?#d)%E?P=H%()'()e#9+:6E?#%(0#*H&+6)HQ6*#'0?(Jb?0#KL#W"#O'EE+(2###########U$+PAQJE%#M::#`%(02#R*)",#Z?K"#;iI@V#

–! ;i#µ<#2%EQ:?2#%*#Iii2#+B#*?2*2pE+#

•! OAA61:)N<""–! !?9?:+Q#(?1#*?=H('o6?2#*+#?a*&%=*#+&#'(B?&#

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•! C1_KAS2:"b2A:)8<"–! !&%E%J=%::L#:+1?&#*H?#K%&&'?&#*+#(?1#B6?:#

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!4"

Task G.1.3 - Support Kinetic Mechanism Development

•! ^1:-<"M==?:?&%*?#*H?#0?9?:+QE?(*#%(0#62?#+B#(?1,#0?*%':?0#N'(?J=#E?=H%('2E2#B+&#*H?#$+PAQJE%#Q&+)&%E#

•! OAA61:)N<""–! $&?%*?#%(L#(?1#+&#E'22'()#&?%=J+(#=:%22?2#*+#=%Q*6&?#(+(P:'(?%&#B6?:#

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–! $&?%*?#(?1#%(%:L2'2#*++:2#62'()#g?&+P4.#*+#E+&?#&%Q'0:L#?9%:6%*?,#9%:'0%*?#+&#'(B?&#B6?:#N'(?J=#'(B+&E%J+(#B&+E#=%(+('=%:#$+PAQJE%#?aQ?&'E?(*2#U?")",#2H+=N#*6K?2,#&%Q'0#=+EQ&?22'+(#E%=H'(?2,#+&#m+1#&?%=*+&2V##

•! C1_KAS2:"b2A:)8<"–! !?:'9?&2#E+&?#%==6&%*?#B6?:#=H?E'2*&L#'(#%#2H+&*?&#JE?#*+#*H?#$+PAQJE%#

%(%:L2'2#

4%Q'0#$+EQ&?22'+(#R%=H'(?#U4$RV#

5+:02K+&+6)HpMF<#

!&"

Task G.2.1 - Extreme Mechanism Reduction for DISI

•! ^1:-<"–! ]EQ&+9?#JE?#*+#&?26:*#+B#*H?#2'E6:%J+(2#

–! ]EQ&+9?#%==6&%=L#+B#Q&?0'=J+(2#

•! OAA61:)N<"V,)+68:E,8."cG:,Se):S1,"`Vca""!?&'9?#?a*&?E?:L#&?06=?0#=H?E'=%:#E?=H%('2E2#62'()#W%L?2'%(#'(B?&?(=?##

–! !?=&?%2?#$CY#=+2*#1H':?#=%Q*6&'()#N'(?J=P0?Q?(0?(*#o6%(JJ?2#+B#'(*?&?2*#U')('J+(#0?:%L#JE?,#m%E?#2Q??0,#H?%*#&?:?%2?,#'&""V##

–! C&+06=?#o6%(Jb?0#?&&+&#K%&2#

•! C1_KAS2:"b2A:)8<"–! q6'=N:L#0?b(?#=H?E'=%:#E?=H%('2E2#K%2?0#+(#(?1#?aQ?&'E?(*%:#

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p(λ|dx

) =p(d

x

|λ) p(λ)p(d

x

)Posterior

Likelihood Prior

Evidence

!R"

Task G.3 - Blendstock-to-Efficiency (B2E) Application

•! ^1:-<"-! $&?%*?#%(0#9%:'0%*?#%#=+EQ&?H?(2'9?#%(0#?c='?(*#

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•! OAA61:)N<""–! <?9?&%)?#2'E6:%J+(#'(Q6*#)?(?&%J+(#B&+E#5"I"I#

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–! Y2?#2'():?#=L:'(0?&#K:?(0'()#*&?(02#'(#E6:JP=L:'(0?&#U5SPC+1?&V#%(%:L2'2#+B#E6:JP=L:'(0?&#SH&62*#]#?aQ?&'E?(*2#

–! <'(N#E6:JP=L:'(0?&#%(%:L2'2#*+#M6*+(+E'?#E+0?:#UB6(0?0#KL#DOOI\7V#B+&#9?H'=:?#2L2*?E#?c='?(=L#

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•! C1_KAS2:"b2A:)8<"–! $&?%*?#%#=+EE+(#:%()6%)?#%(0#

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–! R?%26&?#%(0#ba#1+&Nm+1#K+s:?(?=N2#

–! ]!#)&?%*?2*#2+6&=?2#+B#6(=?&*%'(*L#

!>"

Tracked Milestones

TG+ $.A+ 'E-+981,+9 08:8G9

tp-ip;iI@# &?)"#C&+9'0?#%#&?Q+&*#*+#!A/#%(0#$+PAQJE%#*?%E#+(#*H?#Q?&B+&E%(=?#+B#*H?#2'E6:%J+(#Q%&%E?*?&#)?(?&%J+(#*?=H('o6?2#U+1(?&#F4/<V#

+(#2=H?06:?#

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+(#2=H?06:?#

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+(#2=H?06:?#

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+(#2=H?06:?#

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+(#2=H?06:?#

!["

Reviewer Responses

M:E+2*#%::#+B#*H?#O'E6:%J+(#S++:N'*#*?%Ek2#ZjI@#&?2?%&=H#'2#%#(?1#2*%&*"##SH?#B+::+1'()#%&?#&?2Q+(2?2#*+#2+E?#+B#:%2*#L?%&k2#DSA#Q&+X?=*2#*H%*#%&?#&?:?9%(*#*+#*H?#$+PAQJE%#Q&+)&%Ek2#)+%:2"#

I"! uM$/iI;v#d&4'$'*%$'*%*/#+B'$*,2*5$,0$%+3*%((*2#/-'-*./*!FG*14."4*",#(-*B'*B'H'$*./&'0$%&'-*./"(#-./0I*JKL!I*4.04*M-'(.&)*NG>I*",+5#&%8,/%(*35''-#5I*&,*+%;'*3#$'*&4%&*&4'*&'"4/,(,0.'3*-'<'(,5'-*B)*AOG*1,$;*&,0'&4'$*%/-*2''-*./&,*/''-'-*.+5$,<'+'/&3P*#SH?#O'E6:%J+(#S++:N'*#*?%E#1%2#0?2')(?0#B&+E#*H?#2*%&*#*+#)+#K?L+(0#*H?#*&%0'J+(%:#+&)%('>%J+(#+B#+6&#&?2?%&=H#Q&+)&%E2"##M::#+B#+6&#*%2N2#&?o6'&?#=:+2?#=+::%K+&%J+(#%=&+22#:%K+&%*+&'?2,#2'E6:%J+(#=%Q%K':'J?2,#%(0#*H?#+*H?&#$+PAQJE%#*?%E2"##S+#K?#26==?22B6:,#1?#H%9?#=&?%*?0#%#=+EE6('*L#+B#2H%&?0#=+EQ6J()#%(0#*&%=N?0#0%*%#&?Q+2'*+&'?2#H+2*?0#KL#F4/<"##SH?#*?%E#&?Q&?2?(*2#%::#*H?#M$/#2'E6:%J+(#?w+&*2#%(0#H%2#E%0?#2')('b=%(*#X+'(*#Q&+)&?22#'(#*H?#b&2*#2'a#E+(*H2#+B#$+PAQJE%"#Z6&*H?&,#S%2N#5"-#UW:?(02*+=NP*+P/c='?(=L#MQQ:'=%J+(V#'2#0?2')(?0#*+#'(*?)&%*?#%::#*H?#DSA#%(0#U?9?(*6%:V#Y('9?&2'*L#Q%&*(?&2#'(#%#=+EE+(#B&%E?1+&N"##SH'2#1'::#Q&+9'0?#*H?#$+PAQJE%#Q&+)&%E#*H?#B+::+1'()T#*&?E?(0+62#JE?#2%9'()2#'(#H6E%(#%(0#$CY#=+2*2_#E+&?#&')+&+62#=+EQ%&'2+(#+B#%QQ&+%=H?2_#%(0##

;"! uM$/ix7v#dQ4'*5,$R,(.,*,2*1,$;*34,#(-*B'*%-S#3&'-*3,*+,$'*0%3,(./'*35$%)3*%/-*",+B#38,/*%$'*B'./0*+,-'('-*.2*,/'*4,5'3*&,*.+5%"&*5'&$,('#+*",/3#+58,/*,2*&4'*NA*T''&=P*#SH?#O'E6:%J+(#S++:N'*#*?%E#2?:?=*?0#*H?#M09%(=?0#O]#?()'(?#?aQ?&'E?(*2#1'*H#)%2+:'(?#%(0#K'+P0?&'9?0#K:?(02*+=N2#B+&#S%2N#5"-#UW:?(02*+=NP*+P/c='?(=L#MQQ:'=%J+(V"##SH'2#=%2?#1%2#0?:'K?&%*?:L#=H+2?(#*+#?aQ%(0#%(0#9%:'0%*?#+6&#2'E6:%J+(2#62'()#%#=H%::?()'(),#K6*#9?&L#&?:?9%(*#(?%&P*?&E#%QQ:'=%J+("#A6&#&?2?%&=H#Q:%(#&?m?=*2#%#:%&)?#'(=&?%2?#'(#*H?#DSA#Q+&y+:'+#*+#'(=:60?#)%2+:'(?#2Q&%L#=+EK62J+(#E+0?:'()"#

-" #uZSi;@v#dU."$,DVKQ*.3*%/*.+5,$&%/&*B$'%;&4$,#04*&,*'75'$.+'/&%(*2#'(*<,(#+'3W",3&=P*#SH?#$+PAQJE%#Q&+)&%E#&?=+)('>?2#*H?#?(+&E+62#Q+*?(J%:#*+#%==?:?&%*?#(?1#B6?:2#&?2?%&=H#KL#0?9?:+Q'()#2E%::#9+:6E?,#H')H#*H&+6)HQ6*#N'(?J=#E?%26&?E?(*2"##O'E6:%J+(#'2#?22?(J%:#*+#'(=&?%2?#*H?#2?(2'J9'*L#%(0#%==6&%=L#+B#(?1#0?9'=?2#:'N?#E'=&+PZ]S#%(0#*+#?a*&%=*#N'(?J=#0%*%#B&+E#*H?#]qS#%(0#4$R"##O'E6:%J+(#S++:N'*#*%2N2#5"I";#%(0#5"I"-#0'&?=*:L#26QQ+&*2#*H?2?#?w+&*2"#

!]"

Part II: Accomplishments & Future Work

$:9Q"^(!("#G+-"561A+68."0E2G-:S1,9"S%2N#5"I"I##l##W:?(0'()#E+0?:#B+&#2'E6:%J+(#'(Q6*2#

S%2N#5"I";##l##O'E6:%J+(#26QQ+&*#B+&#2E%::#9+:6E?#B6?:#*?2*?&2#

S%2N#5"I"-##l##O'E6:%J+(#26QQ+&*#B+&#E?=H%('2E#0?9?:+QE?(*#%(0#=%(+('=%:#B6?:#?aQ?&'E?(*2#

$:9Q"^(3("O;P:,)+;"M,FE,+"0E2G-:S1,9"S%2N#5";"I##l##/a*&?E?#E?=H%('2E#&?06=J+(2#B+&#%09%(=?0#

2Q%&N#')('J+(#?()'(?2#U!]O]V#

$:9Q"^(4("L-+,;981)Q_81_MU)E+,)."`L3Ma"OAA-E):S1,"$&?%*?#%(0#9%:'0%*?#%#=+EQ&?H?(2'9?#1+&Nm+1#*+#2'E6:%*?#*H?#'EQ%=*#+B#%#(?1#B6?:#=+EQ+2'J+(#+(#?()'(?#Q?&B+&E%(=?#

Fuel LowGHG

Engine Fuel

ASSERTLowGHG Fuel Engine

!?"

$&?%*?0#%(#%6*+E%*?0#B6?:#26&&+)%*?#+QJE'>?&#*+#Q&+06=?#E+&?#&?%:'2J=#=H?E'2*&L#E+0?:2#B+&#(?1#K:?(02*+=N2#

4?%0L#B+&#2'E6:%J+(#

Z6?:#2Q?=2#B&+E##$+PAQJE%#S?%E2##

Fuel LowGHG

M.]#

O?(2'J9'*L#

!'2J::%J+(#$6&9?#

`p$#&%J+#C]AFM#

Accomplishment: Task G.1.1 - Blending Model for Simulation Surrogate Optimizer

3%"

SH?#26&&+)%*?#+QJE'>?&#+w?&2#%#:%&)?#JE?#2%9'()2#+9?&#*H?#dH%(0P*6(?0e#%QQ&+%=H#Q&?9'+62:L#62?0#KL#*H?#Z6?:#C&+Q?&J?2#*?%E"#

•! /c='?(*:L#=+EQ6*?2#:%&)?#E?=H%('2E2#Uz;iii#2Q?='?2V#

•! /%=H#=%:=6:%J+(#IiPI7a#B%2*?&#*H%(#=+EE?&='%:#2+:9?&2#

•! M9%':%K:?#(+1#+(#Q?&?)&'(?#B+&#%::#####$+PAQJE%#*?%E2#

•! S%&)?*2#=%Q*6&?0#E+&?#%==6&%*?:L#*H%(#H%(0P*6(?0#E?*H+02#

#G8G6+"f16Q<"•! M00#4$R#?aQ?&'E?(*%:#0%*%#

•! M00#0'2*&'K6J+(#+B#=%&K+(#K+(0#*LQ?2#•! YQ0%*?#M.]pO?(2'J9'*L#=+&&?:%J+(2#1'*H#

9'&*6%:#4AF#[#RAF#*?2*2#

Accomplishment: Task G.1.1 - Blending Model for Simulation Surrogate Optimizer

3!"

•! i!#')('J+(#0?:%L#U1'*H#$%(*?&%V#=%:=6:%J+(2#Q?&B+&E?0#B+&#0'w?&?(*#C4Z2#%(0#/-i#=+EQ+2'J+(2#

•! O?(2'J9'*L#+B#')('J+(#0?:%L#JE?#*+#=+EQ+2'J+(#B+&#C4Z#%(0#/-i#K:?(02#

•! SH'2#B+&E2#Q%&*#+B#*H?#+9?&%::#&?:%J+(#K?*1??(#Q?&B+&E%(=?#%(0#K:?(0#=+EQ+2'J+(#

•! Z+&#/-i#=H%()?2#'(#'2+P+=*%(?#B&%=J+(#H%9?#E6=H#E+&?#'EQ%=*##–! $+6:0#'EQ%=*#0+E'(%(*#

*?&E#∂IMEP

∂f=

∂IMEP

∂RON︸ ︷︷ ︸CFD

Virt.CFR︷ ︸︸ ︷dRON

df︸︷︷︸0D

+∂IMEP

∂ . . .

Accomplishment: Task G.1.1 - Blending Model for Simulation Sensitivity of ignition delay time to fuel composition

df︸ ︸+

33"

•! O?(2'J9'*L#2*60L#*+#=H%()'()#C4Z#=+EQ+2'J+(#U{AFV#–! !?*%':?0#E?=H%('2E#

U<<F<#26QQ:'?0V#

–! I#%*E,#xiiPtiiN,#=+(2*%(*#C#&?%=*+&#

–! D%&'?*L#+B#JE?2#6Q#*+#i"IE2##

–! OQ?='?2#2+&*?0#KL#2?(2'J9'*L#*+#AF#K%2?0#+(#C4Z#=+EQ+2'J+(#

•! `')H?2*#2?(2'J9'*L#%*#:+1?&#*?EQ?&%*6&?2#B+&#2%E?#JE?#U?%&:'?&#'(#')('J+(#Q&+=?22V#

X''-3*&,*B'*$'5'%&'-*1.&4*+,$'*",+5(."%&'-*2#'(3I*./*",/S#/"8,/*1.&4*<.$&#%(*FV?*+,-'(3*&,*+%5*;./'8"3W

",+5,3.8,/*&,*5$,5'$8'3*

Accomplishment: Task G.1.1 - Blending Model for Simulation Identification of flow reactor targets to improve accuracy

34"

Accomplishment: Task G.1.1 - Blending Model for Simulation Blending model for biofuel thermophysical properties

A'&%.('-*&$'%&+'/&*,2*&4'$+,-)/%+."3*%/-*&$%/35,$&*5$,5'$8'3*2,$*+#(8",+5,/'/&*2#'(3T#

•! 4?%:Pm6'0#E'a*6&?#Q&+Q?&J?2#+K*%'(?0#62'()#/a*?(0?0#$+&&?2Q+(0'()#O*%*?2#E+0?:#

•! R6:J=+EQ+(?(*#B+&E6:%J+(#62'()#=6K'=#UC4pO4.V#+&#WG4#?o6%J+(2#+B#2*%*?#

•! 5?(?&%:'>?0#*+#*&?%*#1'0?#&%()?#+B#K'+B6?:#K:?(02*+=N2#UZ6?:pAa'0'>?&pC&+06=*2V#

/-i#

$&'J=%:#C+'(*T#C=#n#3I"7#K%&#S=#n#7;\#.#

C&+9'0?2#S%K6:%*?0#](Q6*#B+&#C&+X?=*#$+0?2#U?")",#$AFD/45/VT#•! S?EQ?&%*6&?#•! D'2=+2'*L#•! O6&B%=?#S?(2'+(#•! /(*H%:QL#+B#D%Q+&'>%J+(#•! D%Q+&#C&?226&?#•! SH?&E%:#$+(06=J9'*L#•! !?(2'*L#•! OQ?='b=#`?%*#

?")",#D%&'%J+(#'(#:'o6'0P)%2#0?(2'*L#%(0#9'2=+2'*L#B+&#/-i#%2#B6(=J+(#+B#Q&?226&?#%(0#*?EQ?&%*6&?#2H+1(#+(#&')H*#

3&"

$&?%*?0#%#0?*%':?0#*H?&E%:#E+0?:#*+#o6%(JBL#*H?#*?EQ?&%*6&?#0'w?&?(=?#K?*1??(#*H?#*H?&E+=+6Q:?#%(0#*H?#1%::#=+(0'J+(2#

Accomplishment: Task G.1.2 - Small Volume Fuel Testers Thermal model for µµFIT improves measurement accuracy

ignition extinction

SH?#E'=&+P:'*?&#Z6?:#])('J+(#S?2*?&#UµZ]SV#62?2#%(#6(2*?%0L#m%E?#'(#%#EEP2=%:?#=H%((?:#*+#E?%26&?#B6?:#=H?E'2*&L#?w?=*2#

µZ]S#Q&+*+*LQ?#+Q?&%J()#%*#<OY#KL#O=H+?):#6(0?&#*H?#$+PAQJE%#Z6?:#C&+Q?&J?2#*?%E#UQ&+Q%(?#2H+1(V#

!?*%':?0#E+0?:'()#6(=+9?&?0T#

•! *H?&E+=+6Q:?#H+:0?&#%w?=*2#*H?#E?%26&?0#*?EQ?&%*6&?#'(#*H?#*6K?#

•! *H?&E+=+6Q:?#*&%(2:%J+(#2Q??0#+&')'(%::L#*++#B%2*#

•! z-i.#E?%26&?E?(*#?&&+&#=+&&?=*?0#'(#:?22#*H%(#%#1??N#

mm from burner

TC [K]

cold to hothot to cold

3R"

M==6&%*?#1%::#*?EQ?&%*6&?#E?%26&?E?(*2#%&?#=&'J=%:#*+#?(%K:?#*H?#?a*&%=J+(#+B#N'(?J=#'(B+&E%J+(#µZ]S#B&+E#62'()#2'E6:%J+(#

Future Work: Task G.1.2 - Small Volume Fuel Testers Use simulations to extend µµFIT applicability

G%::#*?EQ?&%*6&?#E?%26&?E?(*#'(#%=J+(#

Z6*6&?#G+&NT#

•! o6%(JBL#*H?#E+0?:#2?(2'J9'*L#%(0#6(=?&*%'(*L#&?2+:9'()#*H?#1%::#*?EQ?&%*6&?#Q&+b:?#

•! &?0?2')(#U1'*H#<OYV#*H?#?a*?&(%:#H?%J()#Q&+b:?#*+#'(=&?%2?#*H?#E?%26&?E?(*#2?(2'J9'*L#B+&#:+1#*?EQ?&%*6&?#H?%*#&?:?%2?#

•! 0?*?&E'(?#*H?#m+1#%(0#H?%J()#=+(0'J+(2#(??0?0#*+#+Q?&%*?#µZ]S#%*#Q&?226&?2#)&?%*?&#*H%(#-i#K%&#

thermocouple bead

translation stage

$`^#b:*?&#

3>"

^#$6&&?(*#$Z4#?()'(?#26&B%=?#E?2H#Q&+9'0?0#KL#!&"#W?(#####G+:N#UOF<V#%(0#C&+B"#8"j"#$H?(#UY$WV#^#$Z4#?()'(?#0%*%#Q&+9'0?0#KL#!&"#D'#4%QQ#%*#<WF<#

•! W+&?#n#\";@7#=E,#2*&+N?#n#II"3-#=E,#=+((?=J()#&+0#n#;7"3#=E,#21?Q*#9+:6E?#n#@I-";7#==,#$4#n#x#

•! S]D$# # n# 73"7i# $,# C]D$# # n# I"I37# K%&,# =L:'(0?&# X%=N?*#*?EQ?&%*6&?#n#\Ii#$,#?()'(?#2Q??0#n#tii#4CR#

•! -!#$:+2?0#=L=:?#4MFO#E+*+&'()#2'E6:%J+(2#B&+E#]D$#*+#/DA#%&?#Q?&B+&E?0#%(0#2H+1(#*+#E%*=H#1?::#1'*H#?aQ?&'E?(*2#

Base grid size = 2 mm Min. grid size = 0.5 mm

Accomplishment: Task G.1.2 - Small Volume Fuel Testers Virtual CFR Engine* based on CFD to estimate RON and MON

#G8G6+"f16Q"•! Z6::#=L=:?#4MFO#%(0#</O#+B#$Z4#?()'(?#'(=+&Q+&%J()#

)%2#?a=H%()?#Q&+=?22?2,#%*#b&?0#=+(0'J+(2#•! .(+=N# =%Q*6&'()# 1'*H# $AFD/45/# 62'()# %0%QJ9?#

E?2H#&?b(?E?(*#•! JE68G:-" ZK*W'K*" 9E2G-:S1," 8+989" H16" F:91-E,+_

+8N:,1-" X-+,;9/" P:-E;:S1," :F:E,98" +DA+6E2+,8:-";:8:"H612"C#Z"+,FE,+9":,;";+P+-1A2+,8"1H",1P+-"8N+16+S):-" )166+-:S1,9" 81" 6:AE;-." ;+8+62E,+"1)8:,+",G2X+69""

•! F?1# $Z4# ?()'(?# %*# MF<# *+# Q&+9'0?# ?aQ?&'E?(*%:#0%*%#'(#B6*6&?###

3["

AKX?=J9?#'2#*+#2*60L#:XE-E8."1H"9G661F:8+"2+)N:,E92"81"):A8G6+"9+,9ESPE8."81"9G661F:8+"HG+-")12A19ES1,9"'(#%#E6:JPQHL2'=2#?(9'&+(E?(*#

Future Work: Task G.1.2 - Small Volume Fuel Testers Ignition Quality Tester experiments and simulations

"

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bF,ES1,"cG:-E8."$+98+6"`bc$a"#

–! C&+B"#5"#W+)'(#U$ORV#1'::#=+(06=*#$AFD/45/#2'E6:%J+(2#+B#]qS#?aQ?&'E?(*2#B+&#?*H%(+:#[######'2+P+=*%(?#K:?(02#

–! ]2+P+=*%(?#K%2?:'(?#?2*%K:'2H?0,#K'(%&L#%(0#&?B?&?(=?#K:?(02#K?'()#2'E6:%*?0#(+1#

–! A(:'(?#E?=H%('2E#&?06=J+(#U!45V#'(=:60?0#*+#?2*%K:'2H#%QQ&+Q&'%*?#:?9?:#+B#&?06=J+(#'(#E?=H%('2E#B+&#=%Q*6&'()#&?%:'2J=#')('J+(#Q&+=?22#

Z6*6&?#G+&NT#

–! $%Q*6&'()#2?(2'J9'J?2#*+#N'(?J=2#0?Q?(0?(*#Q&+Q?&J?2#&?o6'&?2#2'E6:%J+(2#*H%*#=%(#Q&+Q%)%*?#N'(?J=2#2?(2'J9'*L#*H&+6)H#$Z!#=%:=6:%J+(,#'(=:60'()#*6&K6:?(=?Pm%E?#'(*?&%=J+(#

3]"

!?9?:+Q?0#(?1#*++:2#B+&#H')H#*H&+6)HQ6*#E+0?:'()#+B#*H?#=+(2*%(*#Q&?226&?#m+1#&?%=*+&#?aQ?&'E?(*2#UF4/<V#[#4$R#?aQ?&'E?(*2#UMF<V#

Accomplishment: Task G.1.3 - Kinetic Mechanism Support Created two new Zero-RK tools to analyze experiments

•! O'EQ:?#g?&+P4.#'(*?&B%=?#=&?%*?0#+(#Q?&?)&'(?#*+#=+6Q:?#1'*H#?a'2J()#F4/<#QL*H+(#*++:2#

•! z;iia#2Q??06Q#+9?&#$%(*?&%#B+&#*H?#*%&)?*#SH&62*#I#E?=H%('2E#

•! W%*=H#Q&+=?22'()#+B#4$R#2'E6:%J+(2##H%2#H')H#*H&+6)HQ6*#B+&#%6*+E%*?0#+QJE'>%J+(#+B#(?1#B6?:#26&&+)%*?2#

•! F?1#g?&+P4.#*++:#%9+'02#:%&)?#H6E%(#2?*6Q#=+2*#U%(0#?&&+&2V#

3?"

](=&?%2?#*H?#%==6&%=L#+B#*H?#H')HP*H&+6)HQ6*,#=H?E'=%:#N'(?J=2#*++:2#*+#*?2*#*H?#$+PAQJE%#=?(*&%:#B6?:#HLQ+*H?2'2,#%(0#&%Q'0:L#?9%:6%*?#*H?#2?(2'J9'*L#+B#*H?#E?&'*#B6(=J+(#=+?c='?(*2"#

Future Work: Task G.1.3 - Kinetic Mechanism Support Create Zero-RK multizone models of experiments

•! !?9?:+Q#%#E6:J>+(?#E+0?:#B+&#9'&*6%:#4AF#%(0#RAF#?aQ?&'E?(*2#

•! S?2*#9'&*6%:#4AF#%(0#RAF#E+0?:2#'(#*H?#26&&+)%*?#+QJE'>%J+(#:++Q#

•! M==?:?&%*?#*H?#4$R#E+0?:#+B#5+:02K+&+6)H#U$FZ#;iI;V#*+#=%Q*6&?#=&?9'=?#?w?=*2#1'*H#g?&+P4.#

q6%2'P!'E?(2'+(%:#R6:J>+(?#

4%"

Accomplishment: Task G.1.3 - Kinetic Mechanism Development Thrust 1 mechanism reduction

Z:,F+"1H"1A+6:S1,<"!! C&?226&?T#IPIii#%*E#!! /o6'9%:?(=?#&%J+T#i"7P;"i#!! ]('J%:#*?EQ?&%*6&?T#xii#l#I\ii#.#

g"!]"S2+9"6+;G)S1,"

T+8:E-+;"'+)N:,E92"`H612"dd*da"I-t\#2Q?='?2,#7t@-#&?%=J+(2#

"0Q+-+8:-"'+)N:,E92""g3%%"9A+)E+9/"g!%%%"6+:)S1,9"

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1.5

k2 = 3.98× 1014 exp(−40/RT )[CO]1[H2O]0.5[O2]0.25

k−2 = 5.00× 108 exp(−40/RT )[CO2]1

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Task G.3 - Blendstock-to-Efficiency (B2E) Application Accomplishment: Workflow development

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Accomplishment: Task G.3 - Blendstock-to-Efficiency Application High-fidelity DISI engine geometry creation

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Accomplishment: Task G.3 - Blendstock-to-Efficiency Application DISI Engine Simulations

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Accomplishment: Task G.3 - Blendstock-to-Efficiency Application Effect of Fuel properties on engine performance (setup)

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variable description baselin

e min max

T(f,crit) fuel critical temperature

540 k 530 k

550 k

Density fuel density 1.00 0.95 1.05

HOV fuel heat of vaporization

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VP fuel vapor pressure 1.0 0.9 1.1

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Accomplishment: Task G.3 - Blendstock-to-Efficiency Application Effect of Fuel properties on engine performance

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Future Work: Task G.3 - Blendstock-to-Efficiency Application Effect of Fuel properties on DISI engine performance

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Future Work: Task G.3 - Blendstock-to-Efficiency Application Linking engine simulations to efficiency

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Future Work: Task G.3 - Blendstock-to-Efficiency Application Single cylinder engine modeling with KIVA-hpFE

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Future Work: Task G.3 - Blendstock-to-Efficiency Application Multi-cylinder engine performance modeling

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Future Work: New FY17 Task Create tool to search for optimized scenarios w/Co-Optima data

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Summary of FY16 Accomplishments

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Technical Backup Slides

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Approach/Strategy: Six Integrated Teams

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Task G.2.1 – Details on extreme mechanism reduction

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3"! Y2?#L:.+9p"ZG-+":,;"5CM"81"e,;")N+2E):-"A:6:2+8+69"+B#+QJE'>?0#E?=H%('2E#7"! C&+Q%)%*?#Q%&%E?*?&2k#6(=?&*%'(J?2#*+#)?*#?&&+&#K%&2#+(#Q&?0'=J+(#

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•! C&'+&T#N(+1:?0)?#+(#*H?#Q%&%E?*?&2#U&%()?2,#ÑV#•! <'N?:'H++0T#+K*%'(?0#KL#2%EQ:'()#*H?#C$/#'(#Q%&%E?*?&#2Q%=?#•! /9'0?(=?T#(+&E%:'>'()#=+(2*%(*#'(#*H?#Q&?2?(*#=+(*?a*#

p(λ|dx

) =p(d

x

|λ) p(λ)p(d

x

)Posterior

Likelihood Prior

Evidence


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