✦ LIBER ✦

An efficient formulation and implementation of the analytic energy gradient method to the single and double excitation coupled-cluster wave function: Application to Cl2O2

✍ Scribed by Rendell, Alistair P.; Lee, Timothy J.

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Analytic evaluation of energy gradients

✍ Scuseria, Gustavo E. 📂 Article 📅 1991 🏛 American Institute of Physics 🌐 English ⚖ 840 KB

Excitation energies from the coupled clu

✍ Koch, Henrik; Jensen, Hans Jo̸rgen Aa.; Jo̸rgensen, Poul; Helgaker, Trygve 📂 Article 📅 1990 🏛 American Institute of Physics 🌐 English ⚖ 762 KB

Analytic energy gradients for the equati

✍ Stanton, John F.; Gauss, Jürgen 📂 Article 📅 1994 🏛 American Institute of Physics 🌐 English ⚖ 606 KB

Efficient and Accurate Methods for the G

✍ Bates, Desiree M.; Smith, Joshua R.; Tschumper, Gregory S. 📂 Article 📅 2011 🏛 American Chemical Society 🌐 English ⚖ 831 KB

Analytic evaluation of energy gradients

✍ Gustavo E. Scuseria; Andrew C. Scheiner; Julia E. Rice; Timothy J. Lee; Henry F. 📂 Article 📅 1987 🏛 John Wiley and Sons 🌐 English ⚖ 379 KB