Graeme Henkelman - Concepedia

Author

Graeme Henkelman

Also Known As

G Henkelman, G. Henkelman, Graeme A Henkelman, Graeme A. Henkelman, Graeme Henkelman, Grimes, R, Henkelman, Graeme, Henkelman, Graeme A., Jiaao Wang

463

Publications

80.6K

Citations

H-Index

174

Concepts

All Affiliations

The University of Texas at Austin University of Washington

About

Graeme Henkelman is an author at The University of Texas at Austin specializing in engineering, chemistry, and materials science.

Top Concepts

#	Concept	H-Index	Publications	Citations
1	Engineering	72	195	69.6K
2	Natural Sciences	35	54	48.3K
3	Applied Physics	33	52	40.4K
4	Medicine	2	2	62
5	Biochemistry	1	1	26

Graeme Henkelman

282

Publications

78K

Citations

H-Index

Page 1

	Year	Citations
A climbing image nudged elastic band method for finding saddle points and minimum energy paths Graeme Henkelman, Blas P. Uberuaga, Hannes Jónsson The Journal of Chemical Physics EngineeringMechanical EngineeringComputational ChemistryStructural OptimizationComputational Mechanics	2000	20.4K
A fast and robust algorithm for Bader decomposition of charge density Graeme Henkelman, Andri Arnaldsson, Hannes Jónsson Computational Materials Science Numerical AnalysisElectrical EngineeringEngineeringBader DecompositionCharge Density	2005	10K
Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points Graeme Henkelman, Hannes Jónsson The Journal of Chemical Physics Numerical AnalysisEngineeringMechanical EngineeringTangent EstimateComputational Chemistry	2000	9.1K
A grid-based Bader analysis algorithm without lattice bias Wenjie Tang, Edward Sanville, Graeme Henkelman Journal of Physics Condensed Matter Mathematical ProgrammingNumerical AnalysisEngineeringBader VolumesEnergy Minimization	2009	7.3K
Improved grid‐based algorithm for Bader charge allocation Edward Sanville, S.D. Kenny, Roger Smith, Journal of Computational Chemistry EngineeringGrid-based AlgorithmBader VolumesComputational ChemistryChemistry	2007	4.1K
A dimer method for finding saddle points on high dimensional potential surfaces using only first derivatives Graeme Henkelman, Hannes Jónsson The Journal of Chemical Physics Numerical AnalysisEngineeringPotential Energy SurfaceComputational ChemistryChemistry	1999	3.3K
Optimization methods for finding minimum energy paths Daniel Sheppard, Rye Terrell, Graeme Henkelman The Journal of Chemical Physics Numerical AnalysisEngineeringVariational AnalysisMinimum Energy PathwaysRollover Diffusion Mechanism	2008	1.8K
A generalized solid-state nudged elastic band method Daniel Sheppard, Penghao Xiao, William D. Chemelewski, The Journal of Chemical Physics	2012	1.1K
Removal of Interstitial H<sub>2</sub>O in Hexacyanometallates for a Superior Cathode of a Sodium-Ion Battery Jie Song, Long Wang, Yuhao Lu, Journal of the American Chemical Society	2015	911
Comparison of methods for finding saddle points without knowledge of the final states R. A. Olsen, Geert–Jan Kroes, Graeme Henkelman, The Journal of Chemical Physics Numerical AnalysisEngineeringRelevant Saddle PointsComputational ChemistryChemistry	2004	553

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