Commits · e7997c64c54e44229d800a21c2c18f48e523c2bf · Sven Michael Pohl / teqp_fork_old

Apr 01, 2021
- Eliminated one sumproduct · e7997c64
  Ian Bell authored 3 years ago
  
  e7997c64
- Add PC-SAFT model (no dipole or quadrupole contributions) · b9f5585b
  Ian Bell authored 3 years ago
  
  b9f5585b
- Refactor header includes · 435b7e3f
  Ian Bell authored 3 years ago
  
  435b7e3f
- Add (some) virials to the python interface · c1acbabb
  Ian Bell authored 3 years ago
  
  c1acbabb
- More relocating and fixing · fc3e1518
  Ian Bell authored 3 years ago
  
  fc3e1518
- First cut at python wrapper (working brilliantly) · 3cc32668
  Ian Bell authored 3 years ago
  
  3cc32668
Mar 31, 2021
- Fix the catch tests · 36df3c7e
  Ian Bell authored 3 years ago
  
  36df3c7e
- Everything compiles again minus most of the valarray · 3779b027
  Ian Bell authored 3 years ago
  
  Isochoric derivatives moved into their own namespace
  3779b027
- Document models to be added · 39a780f9
  Ian Bell authored 3 years ago
  
  39a780f9
- Tweaks to get multifluid and autodiff to play together · 924d4090
  Ian Bell authored 3 years ago
  
  924d4090
- Reference instead of copy · afdcbf45
  Ian Bell authored 3 years ago
  
  afdcbf45
- Switch Ar02 to autodiff · d952f21a
  Ian Bell authored 3 years ago
  
  d952f21a
- Add B12 · 2b8daac7
  Ian Bell authored 3 years ago
  
  2b8daac7
Mar 30, 2021
- Move vdW tracing into catch test · 98580c31
  Ian Bell authored 3 years ago
  
  98580c31
- Generalize the critical tracing routines for multifluid · 75c18ba7
  Ian Bell authored 3 years ago
  
  75c18ba7
Mar 29, 2021
- Virial coefficient AD backend are also selectable now · e1ccf794
  Ian Bell authored 3 years ago
  
  e1ccf794
- Begin transition to compile-time selection of algorithmic differentiation backend · 38b602a5
  Ian Bell authored 3 years ago
  
  38b602a5
- multifluid compiles now too · 081f418a
  Ian Bell authored 3 years ago
  
  081f418a
- Force a concrete type again · e75e4ca3
  Ian Bell authored 3 years ago
  
  e75e4ca3
- It's compiling in clang now! · f71a8754
  Ian Bell authored 3 years ago
  
  f71a8754
- Avoid expression, use concrete type · 194c2bfe
  Ian Bell authored 3 years ago
  
  194c2bfe
- un-auto type on mask · 2b41a042
  Ian Bell authored 3 years ago
  
  2b41a042
- Repair Ar10 · bf37d01c
  Ian Bell authored 3 years ago
  
  bf37d01c
- Missing dependent type · a2d39c5f
  Ian Bell authored 3 years ago
  
  a2d39c5f
- Two typenames · 91876bd1
  Ian Bell authored 3 years ago
  
  91876bd1
- Begin transition to TDD · 57233369
  Ian Bell authored 3 years ago
  
  57233369
Mar 26, 2021
- Now everything seems to be working with multifluid+autodiff, 10x faster it seems · 150bbbf4
  Ian Bell authored 4 years ago
  
  150bbbf4
- multicomplex critical curve tracing is working again, almost also with autodiff · c81893d9
  Ian Bell authored 4 years ago
  
  c81893d9
Mar 24, 2021
- Correct the virial coefficient calculation · f0c132b9
  Ian Bell authored 4 years ago
  
  f0c132b9
Mar 23, 2021
- Move more to the new mcx namespace · 140afd05
  Ian Bell authored 4 years ago
  
  140afd05
Mar 19, 2021
- Add all the virial coefficients up to the n-th, and a tiny test of this · 3f55682f
  Ian Bell authored 4 years ago
  
  3f55682f
- I seem to have broken autodiff support by the transition to T,rho,molefrac inputs. · cb867cf4
  Ian Bell authored 4 years ago
  
  cb867cf4
- Switch to the log(exp(...)) trick for speedier evaluation of exponential functions · 5799a98f
  Ian Bell authored 4 years ago
  
  5799a98f
- Add updated version of Ar01 · eb34966b
  Ian Bell authored 4 years ago
  
  eb34966b
Mar 18, 2021
- Also add alphar function for vdW · da890fd7
  Ian Bell authored 4 years ago
  
  da890fd7
- Fix second virial coefficient calculation · 7902eb10
  Ian Bell authored 4 years ago
  
  Refactor what is implemented
  7902eb10
Mar 17, 2021
- Start work on virial coefficients. Perplexing for mixtures. · bc145abb
  Ian Bell authored 4 years ago
  
  Fix bug in Ar10
  bc145abb
Mar 12, 2021
- Optionally use autodiff; currently only works for the simple EOS · 182939a8
  Ian Bell authored 4 years ago
  
  182939a8
Mar 11, 2021
- Switch Hessian evaluation to autodiff · 91c4d09c
  Ian Bell authored 4 years ago
  
  Tracing is now crazy fast
  91c4d09c
- autodiff example is working! · 381d948f
  Ian Bell authored 4 years ago
  
  381d948f