GreenGroup/RMG-Java — Issue #247:  jing.rxn.PDepException: Fame output looks like an error occurred.
Author: rajeshdparmar
Created: 2012-02-20 22:25:15+00:00
State: open

As per Prof. Green's guidance we started to build models with pdep ON using smaller molecules such as hexane but unfortunately we are still having problems.

File location:

rajesh@pharos:~/Rajesh/New_jobs_after_Feb-13-2012-butene-rate-corrected/Hexane-conversion-tolerance-0_point_1-pdep-O2_C_0_2$

Error Message:

Created new reverse intra_H_migration reaction: CH3CHCHCH2(782) --> C4H7J(1623)

Solving PDepNetwork #181 (C6H13OJ)
Solving PDepNetwork #253 (C4H9O2J)
For reaction C4H9O2J(338) (included =true) <=> butene_1(210) + HO2(8) (included =true)
Pressure-dependent rate coefficient at 293K 79.8Bar exceeds high-P-limit rate by factor of 2.4 .
For reaction CH3O2J(436) + propene(107) (included =true) <=> C4H9O2J(541) (included =true)
Pressure-dependent rate coefficient at 293K 79.8Bar exceeds high-P-limit rate by factor of 3.1 .
For reaction C4H8O2(934) + H(4) (included =true) <=> C4H9O2J(541) (included =true)
Pressure-dependent rate coefficient at 293K 79.8Bar exceeds high-P-limit rate by factor of 3.3 .
Re-running fame with 501 grains.
Solving PDepNetwork #253 (C4H9O2J)
Solving PDepNetwork #1027 (C6H13O2J)
Solving PDepNetwork #1098 (C5H11O4J)
ERROR: jing.rxn.PDepException: Fame output looks like an error occurred.
at jing.rxn.FastMasterEqn.runPDepCalculation(FastMasterEqn.java:373)
at jing.rxnSys.ReactionSystem.initializePDepNetwork(ReactionSystem.java:542)
at jing.rxnSys.ReactionModelGenerator.modelGeneration(ReactionModelGenerator.java:1495)
at RMG.main(RMG.java:96)

ERROR: Fame output looks like an error occurred.
Could be because of insufficient memory and not actually a problem with FAME or the input files.
Try running fame.exe on its own.
Troublesome FAME input saved to ./fame/1098_input.txt
Troublesome FAME result saved to ./fame/1098_output.txt
CRITICAL: Error running FAME.