𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Derivation and application of second-order uncertainty analysis for normally distributed parameters

✍ Scribed by Y. Ronen; A. Galperin; D.G. Cacuci


Publisher
Elsevier Science
Year
1982
Tongue
English
Weight
403 KB
Volume
9
Category
Article
ISSN
0306-4549

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Efficient computation of potential energ
✍ Robert E. Tuzun; Donald W. Noid; Bobby G. Sumpter 📂 Article 📅 1996 🏛 John Wiley and Sons 🌐 English ⚖ 711 KB

## Abstract By using two‐ and three‐body internal coordinates and their derivatives as intermediates, it is possible to enormously simplify formulas for three‐ and four‐body internal coordinates and their derivatives. Using this approach, simple formulas are presented for stretch (two‐body), two ty

An improved algorithm for analytical gra
✍ Robert A. Distasio JR.; Ryan P. Steele; Young Min Rhee; Yihan Shao; Martin Head- 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 391 KB 👁 2 views

## Abstract We present a new algorithm for analytical gradient evaluation in resolution‐of‐the‐identity second‐order Møller‐Plesset perturbation theory (RI‐MP2) and thoroughly assess its computational performance and chemical accuracy. This algorithm addresses the potential I/O bottlenecks associat