✦ LIBER ✦

The heavy-atom method without Patterson. A symmetry sum function

✍ Scribed by Pavelčík, F.

Book ID: 114500184
Publisher: International Union of Crystallography
Year: 1989
Tongue: English
Weight: 203 KB
Volume: 22
Category: Article
ISSN: 0021-8898
DOI: 10.1107/s0021889888010532

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Generalized method of determining heavy-

Generalized method of determining heavy-atom positions using the difference Patterson function

✍ Terwilliger, T. C. ;Kim, S.-H. ;Eisenberg, D. 📂 Article 📅 1987 🏛 International Union of Crystallography 🌐 English ⚖ 628 KB

An automated deconvolution of the Patter

An automated deconvolution of the Patterson synthesis by means of a modified vector-verification method. Its application to some heavy-atom Patterson functions

✍ Lenstra, A. T. H. ;Schoone, J. C. 📂 Article 📅 1973 🏛 International Union of Crystallography ⚖ 642 KB

The application of effective core potent

The application of effective core potentials in heavy atom molecules: A study of small gold clusters and molecules as a function of theoretical method

✍ Joseph J. Belbruno 📂 Article 📅 1998 🏛 John Wiley and Sons 🌐 English ⚖ 137 KB 👁 2 views

## Geometric parameters and energies have been calculated for the ground and first excited states of the gold dimer using effective core potentials (ECPs) and a range of standard density functional theory (DFT) models. After initial evaluation, the B3P86 theoretical model was the procedure employed