검색결과 : 1건
No. | Article |
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1 |
Harmonic Vibrational Frequencies: Approximate Global Scaling Factors for TPSS, M06, and M11 Functional Families Using Several Common Basis Sets Kashinski DO, Chase GM, Nelson RG, Di Nallo OE, Scales AN, VanderLey DL, Byrd EFC Journal of Physical Chemistry A, 121(11), 2265, 2017 |