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hide red box and fix wrong determinamt equation #59

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Merged
jeanwsr merged 7 commits into from
Nov 27, 2025
Merged

hide red box and fix wrong determinamt equation #59

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31e320a
hide red box
LXYan2333 Nov 27, 2025
c4de16d
fix: wrong determinamt equation
LXYan2333 Nov 27, 2025
8aa0c72
fix: typo
LXYan2333 Nov 27, 2025
16ef618
fix: wrong using of autoref
LXYan2333 Nov 27, 2025
7a9a8a9
Revert "hide red box"
LXYan2333 Nov 27, 2025
d1c46c7
use autoref instead of ref
LXYan2333 Nov 27, 2025
99a7453
Merge branch 'master' into master
LXYan2333 Nov 27, 2025
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2 changes: 1 addition & 1 deletion Chaps/AppendixC.tex
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Expand Up @@ -16,7 +16,7 @@ \section{引言}
随着构象计算的日益成功，人们甚至可以选择孤立分子的计算结果，而不是在凝聚介质中获得的实验结果，因为前者可能更适合气相。

除了产生关于势能面全局最小点的信息外，量子力学计算还可以产生局域最小点的信息，这些局域最小点可能不会被直接观测到，但是
很可能会被包哦旱灾反应路径中。类似的，关于过渡态和能垒的信息也可以得到，这些信息一般很难甚至不可能通过其他方式获得。
很可能会被包含在反应路径中。类似的，关于过渡态和能垒的信息也可以得到，这些信息一般很难甚至不可能通过其他方式获得。

收集一个势能面上这些所有的信息是很困难的。对于N个原子的体系，它的能量是一个具有$3N-6$(或者$3N-5$)个自由度的函数。
为了进行详细的统计计算，人们可能不得不面对这个“3N”问题，并访问势能面上所有热力学可得的区域。
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2 changes: 1 addition & 1 deletion Chaps/Chap1.tex
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Expand Up @@ -456,7 +456,7 @@ \subsection{行列式}
\begin{equation}
\begin{vmatrix}
A_{11} & A_{12} \\ A_{21} &A_{22}
\end{vmatrix} = \left(-1\right)^0 A_{11}A_{12} + \left(-1\right)^1 A_{12}A_{21} = A_{11}A_{12} - A_{12}A_{21}
\end{vmatrix} = \left(-1\right)^0 A_{11}A_{22} + \left(-1\right)^1 A_{12}A_{21} = A_{11}A_{22} - A_{12}A_{21}
\label{eq:1.39}
\end{equation}
由这些定义，我们可以得出以下关于行列式的重要性质：
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