This page documents an OPTIMADE Property Definition. See https://schemas.optimade.org/ for more information.
ID: https://schemas.httk.org/defs/v0.1/properties/trajectories/time_step
Definition name: time_step
Property name: Time step
Description: The molecular-dynamics integration time step between consecutive frames, in femtosecond (fs; 1 fs = 10^-15 s).
A null value indicates that the time step is unknown.
Type: float
Examples:
JSON definition:
{
"$id": "https://schemas.httk.org/defs/v0.1/properties/trajectories/time_step",
"$schema": "https://schemas.optimade.org/meta/v1.3/optimade/property_definition.json",
"title": "Time step",
"x-optimade-type": "float",
"x-optimade-definition": {
"kind": "property",
"version": "0.1.0",
"format": "1.3",
"name": "time_step",
"label": "time_step_trajectories_httk"
},
"x-optimade-unit": "fs",
"x-optimade-unit-definitions": [
{
"$id": "https://schemas.httk.org/defs/v0.1/units/si/general/femtosecond",
"title": "femtosecond",
"symbol": "fs",
"display-symbol": "fs",
"description": "A unit of time equal to 10^-15 seconds.",
"x-optimade-definition": {
"label": "femtosecond_si_general",
"kind": "unit",
"format": "1.2",
"version": "0.1.0",
"name": "femtosecond"
}
}
],
"type": [
"number",
"null"
],
"description": "The molecular-dynamics integration time step between consecutive frames, in femtosecond (fs; 1 fs = 10^-15 s).\nA `null` value indicates that the time step is unknown."
}