Open Access
Table 3
Excess of reactivity calculated with the TRIPOLI4® code for the MISTRAL-1 configuration at 20 °C. The differences Ci − C1 are calculated by using the result obtained with the official T4 library as reference.
Thermal scattering law for H in H2O | Ci − E | Ci − C1 | |
---|---|---|---|
C1 | Official T4 library based on JEFF-3.1.1 | 196 ± 10 pcm | – |
C2 | H(H2O) of the official T4 library is replaced by 1H generated with the Free Gas Model (no THERMR processing) |
958 ± 10 pcm | +762 ± 14 pcm |
C3 | H(H2O) of the official T4 library is replaced by H(H2O) generated from THERMR |
187 ± 10 pcm | -9 ± 14 pcm |
C4 | H(H2O) of the official T4 library is replaced by H(H2O) generated from LEAPR+THERMR |
186 ± 10 pcm | -10 ± 14 pcm |
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