- Mar 22, 2023
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Ian Bell authored
Seems to be fixed now, not sure what the fix was
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- Mar 21, 2023
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Ian Bell authored
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- Mar 03, 2023
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Ian Bell authored
Also test dipolar with JSON
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Ian Bell authored
The references seem to be getting broken. There must be an implicit copy somehow.
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Ian Bell authored
Added into the coeffs structure, nice interface
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Ian Bell authored
Need to decide on how to handle the model composition with the chain models
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Ian Bell authored
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- Mar 02, 2023
- Feb 03, 2023
- Feb 02, 2023
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Ian Bell authored
Can also specify them as JSON-formatted string, to make fitting a bit easier, for instance
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- Jan 25, 2023
- Nov 07, 2022
- Oct 31, 2022
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Ian Bell authored
See #21
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- Oct 19, 2022
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Ian Bell authored
Closes https://github.com/usnistgov/teqp/issues/15
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Ian Bell authored
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svenp authored
* Adding the 2-Center Lennard-Jones model developed by Mecke and the revised version of Lisal * Added dipolar and quadrupolar contributions to 2CLJF model
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- Oct 14, 2022
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Ian Bell authored
Add conversion routines for ideal-gas Helmholtz terms from CoolProp format
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- Oct 11, 2022
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Ian Bell authored
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- Oct 06, 2022
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Ian Bell authored
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- Oct 05, 2022
- Aug 24, 2022
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Ian Bell authored
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- Aug 23, 2022
- Aug 21, 2022
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Ian Bell authored
Found the first real bug in autodiff: https://github.com/autodiff/autodiff/issues/242
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- Aug 19, 2022
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Ian Bell authored
And add test
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- Aug 16, 2022
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Ian Bell authored
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- Aug 10, 2022
- Aug 08, 2022
- Aug 04, 2022
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Ian Bell authored
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- Aug 03, 2022
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Ian Bell authored
A polish was needed after perturbation (duh!)
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