BO molecule

Description

This dataset includes SOC, EAMC, TDM, DM, and PEC data for the BO molecule, as well as absorption spectrum data at temperatures of 298 K, 1000 K, 3000 K, 5000 K, and 10000 K.

Steps to reproduce

This data was obtained through simulation calculations using the Molpro software, DUO program, and Exocross program.

Institutions

• Jilin University

  Jilin, Changchun

Categories

Funders

• National Natural Science Foundation of China

  Beijing, Beijing

  Grant ID: 12274178
• National Natural Science Foundation of China

  Beijing, Beijing

  Grant ID: 11874177
• Swedish Research Council

  Stockholm, Stockholm

  Grant ID: 2022-03405
• Doctoral Research Innovation Capacity Enhancement Program of the Jilim Provincial Department of Education

  Grant ID: 2026KC156

Licence