Commits · master · Ricard Rodríguez / Molecular Dynamics Simulation of a Van der Waals Gas · GitLab

Apr 22, 2025
- Add author to plot.sh scripts · 3ea4544e
  Ricard Rodríguez authored Apr 22, 2025
  
  3ea4544e
- time_plot (parallel): Uncomment measure plot generation · f0287d09
  Ricard Rodríguez authored Apr 22, 2025
  
  f0287d09
- vdw_gas_time (parallel): Remove unused commented lines · 305d144d
  Ricard Rodríguez authored Apr 22, 2025
  
  305d144d
- Update README · 2a829697
  Ricard Rodríguez authored Apr 22, 2025
  
  2a829697
- vdw_gas_time (parallel): Force the removal of previous files · 511f889d
  Ricard Rodríguez authored Apr 22, 2025
  511f889d
Apr 21, 2025
- Merge pull request #43 from SuzuSaratoga/master · 200fe834
  Ricard Rodríguez authored Apr 21, 2025
  200fe834
- Rename real_energies_evolution_temperature_evol.py to... · a322d3d7
  Ricard Rodríguez authored Apr 21, 2025
  a322d3d7
- Rename rdf_rmsd_realunits.py to rdf_rmsd_real_units.py · f3078177
  Ricard Rodríguez authored Apr 21, 2025
  
  f3078177
- Rename rdf_rmsd_realunits.py to rdf_rmsd_real_units.py · 33f30c2b
  Ricard Rodríguez authored Apr 21, 2025
  
  33f30c2b
- Rename real_energies_evolution_temperature_evol.py to... · 09792c5a
  Ricard Rodríguez authored Apr 21, 2025
  09792c5a
- Adding plots folder for parallel and realunits plots · 39c4fcc2
  SuzuSaratoga authored Apr 21, 2025
  
  39c4fcc2
- Updated parallel version vdw_gas.f90 · 0a31c439
  SuzuSaratoga authored Apr 21, 2025
  0a31c439
Apr 20, 2025
- Updated serial vdw_gas.f90 · 7d99fc82
  SuzuSaratoga authored Apr 20, 2025
  7d99fc82
- binning (parallel): Rename binning output file to binning_thermodynamics.dat · fe16930b
  Ricard Rodríguez authored Apr 20, 2025
  fe16930b
- binning (parallel): Comment out debug prints · 7a38ed54
  Ricard Rodríguez authored Apr 20, 2025
  7a38ed54
- io (parallel): Update positions output file writing · ce34845b
  Ricard Rodríguez authored Apr 20, 2025
  ce34845b
- vdw_gas (parallel): Remove unncessary mpi_bcast calls · cb593608
  Ricard Rodríguez authored Apr 20, 2025
  cb593608
- vdw_gas (parallel): Fix output file opening and closing · 86fc073e
  Ricard Rodríguez authored Apr 20, 2025
  86fc073e
- Add time_plot.py · 3be944a9
  Ricard Rodríguez authored Apr 20, 2025
  3be944a9
- vdw_gas_time (parallel): Minor fixes · 0634cb0a
  Ricard Rodríguez authored Apr 20, 2025
  0634cb0a
Apr 19, 2025
- vdw_gas_time (parallel): Generate datafiles of elapsed time per part across number of cores · ab8dfb5c
  Ricard Rodríguez authored Apr 19, 2025
  ab8dfb5c
- Merge pull request #42 from AlejandroDM95/AlejandroDM95-main-adaptation · 747ca331
  Ricard Rodríguez authored Apr 19, 2025
  747ca331
- Merge pull request #41 from AlejandroDM95/AlejandroDM95-parallelization-of-verlet-lists · 77c24883
  Ricard Rodríguez authored Apr 19, 2025
  77c24883
- vdw_gas_time (parallel): Parametrize timestamp string · 32df23f9
  Ricard Rodríguez authored Apr 19, 2025
  32df23f9
- Add vdw_gas_time.sh · c388e95b
  Ricard Rodríguez authored Apr 19, 2025
  c388e95b
- thermostat (parallel): Update code formatting · b9b11621
  Ricard Rodríguez authored Apr 19, 2025
  
  b9b11621
- Update README · 14a42aa5
  Ricard Rodríguez authored Apr 19, 2025
  14a42aa5
- Merge pull request #40 from JoanSerranoMarin/master · 3a3e8fe8
  Ricard Rodríguez authored Apr 19, 2025
  3a3e8fe8
- Merge branch 'Eines-Informatiques-Avancades:master' into master · 399f9dfc
  Joan Serrano Marín authored Apr 19, 2025
  
  399f9dfc
- Mods para que se compile con 4.1.4_ics-2021.3 · 0e330c65
  Joan Serrano Marín authored Apr 19, 2025
  0e330c65
Apr 18, 2025
- Adapt main to verlet list parallelization · 74e26cc9
  AlejandroDM95 authored Apr 18, 2025
  74e26cc9
- Update verlet list computation (parallel) · 05483b32
  AlejandroDM95 authored Apr 18, 2025
  05483b32
- vdw_gas (parallel): Parallel post-trajectory-analysis · 0535c9b8
  Ricard Rodríguez authored Apr 18, 2025
  0535c9b8
- Merge pull request #38 from SuzuSaratoga/master · f5111076
  Ricard Rodríguez authored Apr 18, 2025
  f5111076
- Updated parallel version of post trajectorial analysis · 2aa522e6
  SuzuSaratoga authored Apr 18, 2025
  2aa522e6
- parallel: Change OpenMPI version and compiler · 4e0d1169
  Ricard Rodríguez authored Apr 18, 2025
  4e0d1169
- vdw_gas(parallel): Reenable the Andersen thermostat · 14c4be87
  Ricard Rodríguez authored Apr 18, 2025
  
  14c4be87
- integrators (parallel): Update velocities computation · 2522c758
  Ricard Rodríguez authored Apr 18, 2025
  
  2522c758
Apr 17, 2025
- vdw_gas (parallel): Initial implementation of the thermalization loop · 766673f0
  Ricard Rodríguez authored Apr 18, 2025
  766673f0
- integrators (parallel): Update code formatting · 2185dbb5
  Ricard Rodríguez authored Apr 18, 2025
  
  2185dbb5