【新記事公開！！】 【PySCF】NMRスペクトルを描写【Pythonで始める量子化学計算】 labo-code.com/python/quantum… NMRの基本理論から、結果の解釈方法、可視化まで幅広くカバー。 Google colabで簡単に実行できるので、NMRを測定されている方はぜひご覧ください！ #PySCF #量子化学計算 #NMR
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