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rgoswami  authored a paper 4 days ago

A Tutorial Review of Bayesian Optimization with Gaussian Processes to Accelerate Stationary Point Searches

rgoswami  authored a paper 5 days ago

Enhanced Climbing Image Nudged Elastic Band method with Hessian Eigenmode Alignment

ov-pinka  updated a Space 20 days ago

IEEE/event-budget-prediction

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