Till Grutschus

Nicholas Gao, Till Grutschus, Frank Noé et al.

Neural-network wave functions in Variational Monte Carlo (VMC) have achieved great success in accurately representing both ground and excited states. However, achieving sufficient numerical accuracy in state overlaps requires increasing the number of Monte Carlo samples, and consequently the computational cost, with the number of states. We present a nearly constant sample-size approach, Multi-State Importance Sampling (MSIS), that leverages samples from all states to estimate pairwise overlap. To efficiently evaluate all states for all samples, we introduce Excited Pfaffians. Inspired by Hartree-Fock, this architecture represents many states within a single neural network. Excited Pfaffians also serve as generalized wave functions, allowing a single model to represent multi-state potential energy surfaces. On the carbon dimer, we match the $O(N_s^4)$-scaling natural excited states while training $>200\times$ faster and modeling 50\% more states. Our favorable scaling enables us to be the first to use neural networks to find all distinct energy levels of the beryllium atom. Finally, we demonstrate that a single wave function can represent excited states across various molecules.

Till Grutschus, Ola Karrar, Emir Esenov et al.

This work explores the performance of a large video understanding foundation model on the downstream task of human fall detection on untrimmed video and leverages a pretrained vision transformer for multi-class action detection, with classes: "Fall", "Lying" and "Other/Activities of daily living (ADL)". A method for temporal action localization that relies on a simple cutup of untrimmed videos is demonstrated. The methodology includes a preprocessing pipeline that converts datasets with timestamp action annotations into labeled datasets of short action clips. Simple and effective clip-sampling strategies are introduced. The effectiveness of the proposed method has been empirically evaluated on the publicly available High-Quality Fall Simulation Dataset (HQFSD). The experimental results validate the performance of the proposed pipeline. The results are promising for real-time application, and the falls are detected on video level with a state-of-the-art 0.96 F1 score on the HQFSD dataset under the given experimental settings. The source code will be made available on GitHub.