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Manuscript title: Benchmarking Hierarchical Double-Ended Transition-State Search Methods for Metal-Catalyzed Reactions

DOI: 10.1021/acs.jctc.6c00992

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Title: /main_benchmark/double_ended_runs/NEB_TS_H_uniform_spring reaction-21-nebtsh-noew
Authors: Maiti, Shoubhik
Duarte, Fernanda
Buttar, David
Keywords: Transition metals
Transition states
Computational chemistry
Issue Date: 6-Apr-2026
Publisher: Barcelona Supercomputing Center
Abstract: Reaction-21 NEB-TS(H) with uniform springs (without default energy-weighted springs)
URI: https://iochem-bd.bsc.es/browse/handle/100/492544
Appears in Collections:metal_ts_study - DOI: 10.19061/iochem-bd-6-566

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