Chemistry with ADF

By G. T. Velde, F. Bickelhaupt, E. Baerends, C. F. Guerra, S. V. Gisbergen, J. G. Snijders, T. Ziegler. Journal of Computational Chemistry, 2001

8,362 citations recorded by the source corpus.

Subfields: Atomic and Molecular Physics, and Optics, Spectroscopy

View Paper: https://www.semanticscholar.org/paper/930f6041f86b233c2d4ea0f61f8f16322ef26a01

How researchers see this paper

The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.

In Atomic and Molecular Physics, and Optics

1. Hans Senn
2. Walter Thiel
3. Jinlan Wang

In Spectroscopy

1. Hans Senn
2. Walter Thiel

Citations in the corpus

• Accelerated discovery of stable lead-free hybrid organic-inorganic perovskites via machine learning (2018, methodology): “In Supplementary Table 1, the ionic polarizability, HOMO and LUMO for the A-sites molecules are obtained using Amsterdam Density Functional program package (ADF2013).(19,20) All calculations are carried out by using the PBE functional with the triple-zata plus polarization (TZP)(21) basis set.”