4 citations · 4 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2016★ 4 cited
Accelerating Hartree--Fock exchange calculation using the TURBOMOLE program system: different techniques for different purposes
Arnim Hellweg, Uwe Huniar
Hartree--Fock theory is one of the most ancient methods of computational chemistry, but up to the present day quantum chemical calculations on Hartree--Fock level or with hybrid de…
physics.chem-ph2016
Brick by Brick Computation of the Gibbs Free Energy of Reaction in Solution Using Quantum Chemistry and COSMO-RS
Arnim Hellweg, Frank Eckert
The computational modelling of reactions is simple in theory but can be quite tricky in practice. This article aims at the purpose of providing an assistance to a proper way of des…