请教下各位 有没有遇到过计算过渡态的时候outmol里有时会有能垒 反应能量 而有时没有，如下：
Summary of TS calculation
Energy of reactant : -1356.2138652 Ha
Energy of product : -1356.1773421 Ha
Energy of transition state : -1356.1738097 Ha
Location of transition state : 0.55601
Energy of reaction : 22.919 kcal/mol
Energy of barrier : 25.135 kcal/mol
TS计算成功的了才会有的，不成功outmol只有Energy of reactant : -1356.2138652 Ha
Energy of product : -1356.1773421 Ha
Energy of transition state : -1356.1738097 Ha
Location of transition state : 0.55601
Energy of reaction : 22.919 kcal/mol 这几项
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