Ray Speth
56612115f3
[Input] Create HMWSoln objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
7d964dae47
[Input] Create MaskellSolidSoln objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
d8a1337933
[Input] Create RedlichKister objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
72d345619f
[Input] Create PDSS_SSVol objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
1e8b8b538c
[Input] Create IdealGasVPSS and PDSS_IdealGas objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
a3024d7699
[Input] Create IonsFromNeutral objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
8b47274765
[Input] Create DebyeHuckel and PDSS_Water objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
07aadbce6c
[Test] Add more checks to DebyeHuckel.fromScratch
...
Change species molar volumes to match DH_NaCl_bdotak.xml
2019-06-25 22:30:59 -04:00
Ray Speth
e7c6495ec7
[Input] Create IdealMolalSoln objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
1bdbf2a010
[Input] Create Margules and PDSS_ConstVol objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
6dac1b0409
[Input] Allow mapping for Arrhenius parameters, and use this as the default
...
Pressure-dependent Arrhenius reactions now use a list of mappings instead
of a more complicated nested list structure.
2019-06-25 22:30:59 -04:00
Ray Speth
fdfbc58a1e
[Input] Search current directory for referenced YAML input files
2019-06-25 22:30:59 -04:00
Ray Speth
2c58dd78c6
[Input] Create FixedChemPot objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
d7734e3f19
[Input] Allow "=" as a delimiter for reversible reactions in YAML
2019-06-25 22:30:59 -04:00
Ray Speth
cae5c498ca
[Input] Create WaterSSTP objects from YAML definitions
2019-06-25 22:30:59 -04:00
Ray Speth
98a9566fc4
[Input] Create StoichSubstance objects from YAML definitions
...
The (fixed) density is now read from the species definition, rather than the
phase definition.
2019-06-25 22:30:59 -04:00
Ray Speth
f0dc990764
Create a complete Kinetics object from a YAML input file
2019-06-25 22:30:59 -04:00
Ray Speth
f4d45f8a85
Create a complete ThermoPhase object from a YAML input file
2019-06-25 22:30:59 -04:00
Ray Speth
c8b737035d
[Thermo] Add method for setting the state using an AnyMap
...
Analogous to ThermoPhase::setStateFromXML, but more flexible
2019-06-25 22:30:59 -04:00
Ray Speth
7d3488a973
Add AnyMap.keys_str function
2019-06-25 22:30:59 -04:00
Ray Speth
a32e32b7d7
Remove AnyMap traversal using "/" as a path delimiter
...
This feature was unused, and interfered with the use of "/" as a delimiter
for YAML keys indicating keys in other input files.
2019-06-25 22:30:59 -04:00
Ray Speth
71bf44d11f
[Input] Parse YAML entries for Species objects
2019-06-25 22:30:59 -04:00
Ray Speth
84fa231ea2
[Input] Read local 'units' definitions in reaction and thermo entries
...
Move 'convert' functions that work with missing keys to AnyMap class.
2019-06-25 22:30:59 -04:00
Ray Speth
6e3053dd1c
Add function for setting default units from a std::map
...
This is the form that will be used when reading units from a YAML
input file.
2019-06-25 22:30:59 -04:00
Ray Speth
4c5040e829
[Input] Parse YAML entries for piecewise Gibbs (Mu0Poly) species thermo
2019-06-25 22:30:59 -04:00
Ray Speth
f0bb0d2262
Make AnyMap iterable
2019-06-25 22:30:59 -04:00
Ray Speth
86c73dad20
[Input] Parse YAML entries for constant cp species thermo
2019-06-25 22:30:59 -04:00
Ray Speth
74eec731f1
Add a version of UnitSystem.convert that handles default values
2019-06-25 22:30:59 -04:00
Ray Speth
7211f08891
[Input] Parse YAML entries for NASA 9-coefficient polynomials
2019-06-25 22:30:59 -04:00
Ray Speth
7ff6e8fac2
[Input] Parse YAML entries for Shomate polynomials
2019-06-25 22:30:59 -04:00
Ray Speth
2b41486850
[Input] Parse YAML entries for NASA 7-coefficient polynomials
2019-06-25 22:30:59 -04:00
Ray Speth
aef101fee7
[Input] Parse YAML entries for Chebyshev reactions
2019-06-25 22:30:59 -04:00
Ray Speth
7a97ff9917
Add optional length check when converting AnyValue to vector
2019-06-25 22:30:59 -04:00
Ray Speth
b54ea8bd82
[Input] Parse YAML entries for Plog reactions
2019-06-25 22:30:59 -04:00
Ray Speth
cb31c297cf
[Input] Parse YAML entries for falloff and chemically activated reactions
2019-06-25 22:30:59 -04:00
Ray Speth
8b502d4065
[Input] Parse YAML entries for three body reactions
2019-06-25 22:30:59 -04:00
Ray Speth
0220e11ef9
Allow conversion from long int to double in AnyValue.asMap
2019-06-25 22:30:59 -04:00
Ray Speth
de80f06887
[Input] Parse YAML entries for elementary reactions
2019-06-25 22:30:59 -04:00
Ray Speth
224c46ebbb
Add functions for converting units from AnyValue instances
2019-06-25 22:30:59 -04:00
Ray Speth
65121becac
Add special handling of activation energies to class Units
2019-06-25 22:30:59 -04:00
Ray Speth
da097631e3
UnitSystem class supports default source units for conversions
2019-06-25 22:30:59 -04:00
Ray Speth
c9b7de3b70
Add support for metric prefixes to class Units
2019-06-25 22:30:59 -04:00
Ray Speth
b8cb2c30f8
Add 'Units' class for doing conversions with dimensionality checks
...
Introduces a new, more natural notation for writing unit strings,
for use in YAML input files. Unlike 'toSI', conversions are checked for
dimensional consistency.
2019-06-25 22:30:59 -04:00
Ray Speth
ea88d4f9fb
Add "get" functions to AnyMap
...
Simplify the common use case of checking for a key and using a default
value when it is missing.
2019-06-25 22:30:59 -04:00
Ray Speth
530adbb931
Add automatic conversions to vector<AnyValue>
2019-06-25 22:30:59 -04:00
Ray Speth
e5bd0b136f
Allow AnyValue to convert implicitly from long int to double
2019-06-25 22:30:59 -04:00
Ray Speth
00f6b88fa4
[Input] Implement construction of AnyMap from YAML string/file
2019-06-25 22:30:59 -04:00
Ray Speth
d6d91f4d98
[Thermo] Fix updating state of PDSS_IonsFromNeutral objects
...
Setting T and P now updates the state of the underlying "neutral
molecule phase".
Also removed the unimplemented setState_TR method.
2019-03-06 19:50:16 -05:00
Ray Speth
aceb896f62
[Thermo] Fix BinarySolutionTabulatedThermo updates when only T changes
...
In the case where temperature changes but the mole fractions are the same, we
still need to apply the enthalpy and entropy offsets to the tabulated species.
2019-03-06 19:48:45 -05:00
Ray Speth
ec7f779434
[Input] Include more significant digits for Redlich-Kwong coefficients
...
ctml_writer was severely truncating Redlich-Kwong coefficients when converting
from CTI to XML formats, keeping only 5 significant digints in the "a"
coefficients and two decimal digits in the "b" coefficients, which is less than
what is used even in the example CTI files. The use of the "%f" format also
meant that the precision depended on input units.
2019-03-05 16:09:55 -05:00
