An improved chain of spheres for exchange algorithm
Benjamin Helmich‐Paris(Max-Planck-Institut für Kohlenforschung), Róbert Izsák(Riverlane (United Kingdom)), Frank Neese(Max-Planck-Institut für Kohlenforschung), Bernardo de Souza(TH Köln - University of Applied Sciences)
Cited by 528
Related Papers
Predicting Phosphorescence Rates of Light Organic Molecules Using Time-Dependent Density Functional Theory and the Path Integral Approach to Dynamics
|Journal of Chemical Theory and Computation|2019|327
On the theoretical prediction of fluorescence rates from first principles using the path integral approach
|The Journal of Chemical Physics|2018|261
GOAT: A Global Optimization Algorithm for Molecules and Atomic Clusters
|Angewandte Chemie International Edition|2025|146
Persistent Solid‐State Phosphorescence and Delayed Fluorescence at Room Temperature by a Twisted Hydrocarbon
|Angewandte Chemie International Edition|2019|117
PEI-coated gold nanoparticles decorated with laccase: A new platform for direct electrochemistry of enzymes and biosensingapplications
|Biosensors and Bioelectronics|2012|98