Trajectory

Load Trajectory

Drop a trajectory file here (.xyz, .extxyz, .json, .json.gz, XDATCAR, .traj, .h5) or provide trajectory data via props

Supported formats:
  • Multi-frame XYZ trajectory files (.xyz, .extxyz)
  • ASE trajectory files (.traj)
  • Pymatgen trajectory JSON
  • Array of structures with metadata
  • VASP XDATCAR files
  • HDF5 trajectory files (.h5, .hdf5)
  • Compressed files (.gz)

πŸ’‘ Force vectors will be automatically displayed when present in trajectory data

Load Trajectory

Drop a trajectory file here (.xyz, .extxyz, .json, .json.gz, XDATCAR, .traj, .h5) or provide trajectory data via props

Supported formats:
  • Multi-frame XYZ trajectory files (.xyz, .extxyz)
  • ASE trajectory files (.traj)
  • Pymatgen trajectory JSON
  • Array of structures with metadata
  • VASP XDATCAR files
  • HDF5 trajectory files (.h5, .hdf5)
  • Compressed files (.gz)

πŸ’‘ Force vectors will be automatically displayed when present in trajectory data

Bindable visible_properties Demo

This trajectory has multiple properties (energy, force_max, volume, etc.). The plot shows those defined in the visible_properties on page load. But the prop is two-way bindable and allows for external monitoring and modification. Toggle other properties in the plot legend to see the binding below update to show which properties are currently displayed.

bind:visible_properties =

Load Trajectory

Drop a trajectory file here (.xyz, .extxyz, .json, .json.gz, XDATCAR, .traj, .h5) or provide trajectory data via props

Supported formats:
  • Multi-frame XYZ trajectory files (.xyz, .extxyz)
  • ASE trajectory files (.traj)
  • Pymatgen trajectory JSON
  • Array of structures with metadata
  • VASP XDATCAR files
  • HDF5 trajectory files (.h5, .hdf5)
  • Compressed files (.gz)

πŸ’‘ Force vectors will be automatically displayed when present in trajectory data

Load Trajectory

Drop a trajectory file here (.xyz, .extxyz, .json, .json.gz, XDATCAR, .traj, .h5) or provide trajectory data via props

Supported formats:
  • Multi-frame XYZ trajectory files (.xyz, .extxyz)
  • ASE trajectory files (.traj)
  • Pymatgen trajectory JSON
  • Array of structures with metadata
  • VASP XDATCAR files
  • HDF5 trajectory files (.h5, .hdf5)
  • Compressed files (.gz)

πŸ’‘ Force vectors will be automatically displayed when present in trajectory data

Load Trajectory

Drop a trajectory file here (.xyz, .extxyz, .json, .json.gz, XDATCAR, .traj, .h5) or provide trajectory data via props

Supported formats:
  • Multi-frame XYZ trajectory files (.xyz, .extxyz)
  • ASE trajectory files (.traj)
  • Pymatgen trajectory JSON
  • Array of structures with metadata
  • VASP XDATCAR files
  • HDF5 trajectory files (.h5, .hdf5)
  • Compressed files (.gz)

πŸ’‘ Force vectors will be automatically displayed when present in trajectory data

Drag any of these trajectory files onto a viewer above to load them:

  HDF5 JSON TRAJ UNKNOWN XDATCAR XYZ
Cr0.25Fe0.25Co0.25Ni0.25-mace-omat-qha.xyz.gz πŸ“¦
V8Ta12W71Re8-mace-omat.xyz
ase-LiMnO2-chgnet-relax.traj
ase-images-Ag-0-to-97.xyz.gz πŸ“¦
cell_0_T_800.0_dmu_0.3129032258064516.lammpstrj.gz πŸ“¦
flame-gold-cluster-55-atoms.h5
flame-water-cluster-bad-file.h5
gold-nanoparticle-md.h5
lammps-sample.lammpstrj.gz πŸ“¦
mdanalysis-additional-columns.lammpstrj
mdanalysis-chain-dump.lammpstrj
mp-1184225.extxyz
pymatgen-LiMnO2-chgnet-relax.json.gz πŸ“¦
unsupported-binary-bad-file.bin
vasp-XDATCAR-traj.gz πŸ“¦
vasp-XDATCAR.MD.gz πŸ“¦
wat.lammpstrj_long.bz2