DFT Calculations for the HONO Elimination Process of CL-20 Conformers

Table 2

Arrhenius parameters of the elimination reactions.

Reaction	A/(s^−1)	Ea/(kJ/mol)
R11	2.17 E + 10	289.62
R12	1.74 E + 20	204.28
R21	3.94 E + 07	294.56
R22	5.18 E + 19	43.14
R23	1.98 E + 19	92.52
R31	1.82 E + 11	307.11
R32	2.26 E + 12	222.86
R33	1.10 E + 12	283.19
R41	4.29 E + 11	291.95
R42	3.74 E + 13	248.03
R43	1.09 E + 12	282.20