𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Pseudospectral Local Second-Order Møller−Plesset Methods for Computation of Hydrogen Bonding Energies of Molecular Pairs

✍ Scribed by Kaminski, George A.; Maple, Jon R.; Murphy, Robert B.; Braden, Dale A.; Friesner, Richard A.


Book ID
125968876
Publisher
American Chemical Society
Year
2005
Tongue
English
Weight
49 KB
Volume
1
Category
Article
ISSN
1549-9618

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Calculation of frequency-dependent polar
✍ Takao Kobayashi; Kotoku Sasagane; Kizashi Yamaguchi 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 184 KB 👁 2 views

We extended the dynamic response theory in the Møller᎐Plesset Ž . Ž . perturbation theory MPPT based on the quasi-energy derivative QED method for closed-shell systems to that for open-shell systems. In this study we perform the Ž . calculations of frequency-dependent polarizabilities ␣ y; for nonde