yVxxJR7Yz6kyFk8V1NJYnbSMO7fiVCVUKYxJuUKvgEdnhlGuEmg4R6jI8aoV
location: Current position: Home >> Scientific Research >> Paper Publications

O1NumHess: A Fast and Accurate Seminumerical Hessian Algorithm Using Only O(1) Gradients

Hits:

Journal:J. Chem. Theory Comput.

First Author:B. Wang

Correspondence Author:Z. Wang*,W. Liu*

All the Authors:S. Luo

Issue:https://doi.org/10.1021/acs.jctc.5c01354

Translation or Not:No

Date of Publication:2025-10

Next One:Machine Learned Fock Matrix