Tom Ziegler

Chemistry with ADF

G. te Velde, F. Matthias Bickelhaupt, Evert Jan Baerends et al. · Journal of Computational Chemistry · 2001 · 9.9K citations

Engineering, Chemical Analysis, Theoretical Inorganic Chemistry +17

On the calculation of bonding energies by the Hartree Fock Slater method

Tom Ziegler, Arvi Rauk · Theoretical Chemistry Accounts · 1977 · 2.4K citations

Engineering, Physics, Natural Sciences +8

A Combined Charge and Energy Decomposition Scheme for Bond Analysis

Mariusz P. Mitoraj, Artur Michalak, Tom Ziegler · Journal of Chemical Theory and Computation · 2009 · 1.8K citations · Full text

The determination of molecular structures by density functional theory. The evaluation of analytical energy gradients by numerical integration

Louis Versluis, Tom Ziegler · The Journal of Chemical Physics · 1988 · 1.3K citations

Engineering, Computational Chemistry, Chemistry +16

A theoretical study of the ethylene-metal bond in complexes between copper(1+), silver(1+), gold(1+), platinum(0) or platinum(2+) and ethylene, based on the Hartree-Fock-Slater transition-state method

Tom Ziegler, Arvi Rauk · Inorganic Chemistry · 1979 · 1.2K citations

Ethylene-metal Bond, Hartree-fock-slater Transition-state Method, Engineering +17