化学プロセスにおけるNO2,N2O4,cis-ONO-NO2,trans-ONO-NO2の相互変換の役割に関する第一原理の研究

Wei-Guang Liu1, William A Goddard

  • 1Materials and Process Simulation Center, California Institute of Technology , Pasadena, California 91125, United States.

まとめ

量子力学の研究は,二酸化窒素 (NO2) 二酸化窒素 (NO2) 二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素二酸化窒素 対称なN2O4二酸化物形成は障壁がないが,シス同位体とトランス同位体はエネルギー障壁が異なる.

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