دورية أكاديمية
Affordable Ab Initio Path Integral for Thermodynamic Properties via Molecular Dynamics Simulations Using Semiempirical Reference Potential.
| العنوان: | Affordable Ab Initio Path Integral for Thermodynamic Properties via Molecular Dynamics Simulations Using Semiempirical Reference Potential. |
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| المؤلفون: | Yuanfei Xue, Jia-Ning Wang, Wenxin Hu, Jun Zheng, Yongle Li, Xiaoliang Pan, Yan Mo, Yihan Shao, Lu Wang, Ye Mei |
| المصدر: | Journal of Physical Chemistry A; 12/23/2021, Vol. 125 Issue 50, p10677-10685, 9p |
| قاعدة البيانات: | Supplemental Index |
| تدمد: | 10895639 |
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| DOI: | 10.1021/acs.jpca.1c07727 |