The DOI matches its Crossref record; 126 of the 126 references it cites were found in a registry or an index.
Finding minima, transition states, and following reaction pathways on ab initio potential energy surfaces
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Citations
Cites
A climbing image nudged elastic band method for finding saddle points and minimum energy paths
Henkelman, G., Uberuaga, B. P., & Jónsson, H. (2000) · The Journal of Chemical Physics · doi:10.1063/1.1329672 · Cited by 21,620
Henkelman, G., & Jónsson, H. (2000) · The Journal of Chemical Physics · doi:10.1063/1.1323224 · Cited by 9,523
On the limited memory BFGS method for large scale optimization
Liu, D. C., & Nocedal, J. (1989) · Mathematical Programming · doi:10.1007/bf01589116 · Cited by 8,560
Numerical Methods for Unconstrained Optimization and Nonlinear Equations
Dennis, J. E., & Schnabel, R. B. (1996) · Society for Industrial and Applied Mathematics eBooks · doi:10.1137/1.9781611971200 · Cited by 7,615
The path of chemical reactions - the IRC approach
Fukui, K. (1981) · Accounts of Chemical Research · doi:10.1021/ar00072a001 · Cited by 6,638
An improved algorithm for reaction path following
Gonzalez, C., & Schlegel, H. B. (1989) · The Journal of Chemical Physics · doi:10.1063/1.456010 · Cited by 6,159
Self-citationReaction path following in mass-weighted internal coordinates
Gonzalez, C., & Schlegel, H. B. (1990) · The Journal of Physical Chemistry · doi:10.1021/j100377a021 · Cited by 5,991
Self-citationPractical methods of optimization
(1988) · Mathematics and Computers in Simulation · doi:10.1016/0378-4754(88)90129-2 · Cited by 5,818
Introduction to Computational Chemistry
Jensen, F. (1998) · Cited by 4,669
Warshel, A., & Levitt, M. (1976) · Journal of Molecular Biology · doi:10.1016/0022-2836(76)90311-9 · Cited by 4,479
Cited by
Brovarets, O. O., & Hovorun, D. M. (2014) · Journal of Biomolecular Structure and Dynamics · doi:10.1080/07391102.2012.755795 · Cited by 148
Brovarets’, O. O., & Hovorun, D. M. (2014) · Journal of Biomolecular Structure and Dynamics · doi:10.1080/07391102.2013.822829 · Cited by 96
Sattayanon, C., Sontising, W., Jitonnom, J., Meepowpan, P., Punyodom, W., & Kungwan, N. (2014) · Computational and Theoretical Chemistry · doi:10.1016/j.comptc.2014.06.008 · Cited by 36
Brovarets’, O. O., & Hovorun, D. M. (2019) · Journal of Biomolecular Structure and Dynamics · doi:10.1080/07391102.2018.1467795 · Cited by 32
Initiation of ring-opening polymerization of lactide: The effect of metal alkoxide catalyst
Cheshmedzhieva, D., Angelova, I., Ilieva, S., Georgiev, G. S., & Galabov, B. (2012) · Computational and Theoretical Chemistry · doi:10.1016/j.comptc.2012.06.015 · Cited by 27
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- CoChat. (2026). Citation check: Finding minima, transition states, and following reaction pathways on ab initio potential energy surfaces. https://app.cochat.ai/papers/10.1016/b978-044451719-7/50053-6
- The paper
- Hratchian, H. P., & Schlegel, H. B. (2005). Finding minima, transition states, and following reaction pathways on ab initio potential energy surfaces. Theory and Applications of Computational Chemistry. https://doi.org/10.1016/b978-044451719-7/50053-6
Data sources
Bibliographic data: Semantic Scholar, OpenAlex, Crossref.
Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).
Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.
