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Thermo Tutorials

Lesson 1 -- Calculate the thermodynamic properties

Objective:* Calculate the thermodynamic properties, H, Cp, and S of ethylene as functions of the temperature. Results are presented in the CHEMKIN format for reaction energineering simulations. Input information is taken from a quantum chemistry calculation.

Lesson 2 -- Calculate the thermodynamic properties

Objective:

Lesson 3 -- Calculate the thermodynamic properties

Objective:
Topic attachments
I Attachment Action Size Date Who Comment
elselog C2H4.log manage 135.9 K 29 Aug 2006 - 18:52 LamHuynh Linux Gaussian output file for ethylene (CH2=CH2) with the resquest of optimization and frequency calculation
elseFChk C2H4.FChk manage 68.6 K 29 Aug 2006 - 18:52 TWikiGuest Fchk file for ethylene
elseinp C2H4.therm.inp manage 0.7 K 29 Aug 2006 - 18:52 LamHuynh Thermo input file for ethylene
elseout C2H4.therm.out manage 4.2 K 29 Aug 2006 - 18:52 LamHuynh Thermo output file for ethylene
elseEXT ProjectPlannerPlugin manage 4.0 K 17 Jun 2007 - 19:11 UnknownUser  
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