# 分子模擬 HW2 ###### tags: `Molecular Simulation` :::danger :white_check_mark: **Total score: 100 pts, Problem1: 30%, Program 40%, Problem3: 30%** ::: :::danger :white_check_mark: **`f_vdw()` Correct: ==10 pts==** :white_check_mark: **`f_bond` Correct: ==10 pts==** :white_check_mark: **Compile Successfully: ==10 pts==** :white_check_mark: **Execute Successfully: ==10 pts==** ::: # 較常見的錯誤 ## Problem 1 1. 只寫一項,例如只寫出 $f_i$ 但沒有寫出 $f_j$:==-5 pts== 2. 正負號錯誤:==-5 pts== ## Program 1. `f_vdw` 沒有計算使用 PBC 時的距離: ==-5 pts== 2. `f_bond` 使用 PBC 計算距離(不需使用): ==-5 pts== 4. 沒有計算stress: ==-5 pts== ## Problem 3 1. 報告中無法看出有更換 Random Seed 跑五次取平均: ==-5 pts== 2. 沒有放圖: ==-10pts==
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