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20202026
most citedHigh-Dimensional Neural Network Potentials for Magnetic Systems Using Spin-Dependent Atom-Centered Symmetry Functions

93 citations · 363 across the 16 of their papers we have counts for

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physics.chem-ph2026

RuNNer 2.0: A Software Suite for High-Dimensional Neural Network Potentials

Alexander L. M. Knoll, Moritz R. Schäfer, K. Nikolas Lausch +11

We present RuNNer 2.0, the "Ruhr University Neural Network energy representation", a highly optimized software suite for training and evaluating high-dimensional neural network pot…

quant-ph2026★ 1 cited

QDK/Chemistry: A Modular Toolkit for Quantum Chemistry Applications

Nathan A. Baker, Brian Bilodeau, Chi Chen +23

We present QDK/Chemistry, a software toolkit for quantum chemistry workflows targeting quantum computers. The toolkit addresses a key challenge in the field: while quantum algorith…