---
code_id: 16776
site_ownership_code: "SNL"
open_source: true
repository_link: "https://github.com/zadorlab/KinBot"
project_type: "OS"
software_type: "S"
official_use_only: {}
developers:
- email: "jzador@sandia.gov"
  orcid: ""
  first_name: "Judit"
  last_name: "Zador"
  middle_name: ""
  affiliations: []
- email: "rvandev@sandia.gov"
  orcid: ""
  first_name: "Ruben"
  last_name: "Van de Vijver"
  middle_name: ""
  affiliations: []
contributors: []
sponsoring_organizations:
- organization_name: "USDOE"
  funding_identifiers: []
  primary_award: "NA0003525"
  DOE: true
contributing_organizations: []
research_organizations:
- organization_name: "Sandia National Laboratories (SNL-NM), Albuquerque, NM (United\
    \ States)"
  DOE: true
related_identifiers: []
release_date: "2018-08-01"
software_title: "KinBot"
acronym: "KinBot"
doi: "https://doi.org/10.11578/dc.20180906.1"
description: "KinBot 2.0 searches for chemical reaction pathways for gas-phase systems\
  \ containing C, H, and O atoms. It determines the structure of key intermediates\
  \ and products, characterizes their molecular structure and related properties,\
  \ and creates an output that can be conveniently used to calculate rate coefficients\
  \ by other codes."
programming_languages:
- "Python"
version_number: ""
country_of_origin: "United States"
licenses:
- "BSD 3-clause \"New\" or \"Revised\" License"
recipient_org: "Sandia National Laboratories"
site_accession_number: "SCR#2329"
date_record_added: "2018-08-24"
date_record_updated: "2018-09-06"
is_file_certified: false
is_limited: false
links:
- rel: "citation"
  href: "https://www.osti.gov/doecode/biblio/16776"