Hyperfine coupling constants of dimethyl nitroxide in aqueous solution: Car–Parrinello molecular dynamics and discrete-continuum approaches

• 作者Michele Pavone; Caterina Benzi; Filippo De Angelis; Vincenzo Barone
• 卷第395卷
• 印刷ISSN0009-2614
• 文件大小325.05KB
• 发表时间2004
• DOI10.1016/j.cplett.2004.07.054
• 页码120-126