Exploring potential energy surfaces to reach saddle points above convex regions

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Amorphous silicon structures generated using a moment tensor potential and the activation relaxation technique nouveau

K Zongo, H Sun, C Ouellet-Plamondon… - arxiv preprint arxiv …, 2025 - arxiv.org
Preparing realistic atom-scale models of amorphous silicon (a-Si) is a decades-old
condensed matter physics challenge. Herein, we combine the Activation Relaxation …
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