Guntram Rauhut - Concepedia

Author

Guntram Rauhut

University of Stuttgart ORCID

Also Known As

G Rauhut, G. RAUHUT, G. Rauhut, Guntram Rauhut, Rauhut, Guntram

206

Publications

8.4K

Citations

H-Index

105

Concepts

All Affiliations

University of Stuttgart Fudan University Soochow University University of Arkansas at Fayetteville

About

Guntram Rauhut is an author at University of Stuttgart specializing in natural sciences, engineering, and quantum chemistry.

Top Concepts

#	Concept	H-Index	Publications	Citations
1	Engineering	36	75	6.7K
2	Natural Sciences	36	72	6.6K
3	Applied Physics	17	23	1.1K
4	Biochemistry	5	5	141
5	Medicine	2	2	301

Guntram Rauhut

112

Publications

Citations

H-Index

Page 1

	Year	Citations
Transferable Scaling Factors for Density Functional Derived Vibrational Force Fields Guntram Rauhut, Péter Pulay The Journal of Physical Chemistry EngineeringMultiscale MechanicsMechanical EngineeringDatabasesAltmetric Attention Score	1995	1.9K
Energy-consistent pseudopotentials for group 11 and 12 atoms: adjustment to multi-configuration Dirac–Hartree–Fock data Detlev Figgen, Guntram Rauhut, Michael Dolg, Chemical Physics Energy-consistent PseudopotentialsEngineeringPhysicsGroup 11Natural Sciences	2004	965
Efficient calculation of potential energy surfaces for the generation of vibrational wave functions Guntram Rauhut The Journal of Chemical Physics Numerical AnalysisIntroduced ApproximationsEngineeringComputational ChemistryWave Motion	2004	298
Local Treatment of Electron Correlation in Molecular Clusters: Structures and Stabilities of (H<sub>2</sub>O)<i><sub>n</sub></i>,<i>n</i>= 2−4 Martin Schütz, Guntram Rauhut, Hans‐Joachim Werner The Journal of Physical Chemistry A EngineeringLmp2 EnergiesComputational ChemistryStrongly Correlated Electron SystemsChemistry	1998	238
Analytical energy gradients for local second-order Mo/ller–Plesset perturbation theory Adel El Azhary, Guntram Rauhut, Péter Pulay, The Journal of Chemical Physics EngineeringPerturbation MethodPhysicsNatural SciencesLmp2 Energy	1998	217
Comparison of NMR Shieldings Calculated from Hartree−Fock and Density Functional Wave Functions Using Gauge-Including Atomic Orbitals Guntram Rauhut, Steve Puyear, Krzysztof Woliński, The Journal of Physical Chemistry PhysicsNmr ShieldingsSpectroscopyNatural SciencesScf Theory	1996	208
Toward large scale vibrational configuration interaction calculations Michael Neff, Guntram Rauhut The Journal of Chemical Physics Modal AnalysisNumerical AnalysisEngineeringPhysicsPolynomial Representation	2009	199
Accurate calculation of vibrational frequencies using explicitly correlated coupled-cluster theory Guntram Rauhut, Gerald Knizia, Hans‐Joachim Werner The Journal of Chemical Physics Numerical AnalysisT. B. AdlerEngineeringComputational ChemistryChemistry	2009	186
A numerical self-consistent reaction field (SCRF) model for ground and excited states in NDDO-based methods Guntram Rauhut, Timothy Clark, Thomas Steinke Journal of the American Chemical Society Numerical AnalysisLocalized Excited StateEngineeringAltmetric Attention ScoreComputational Chemistry	1993	176
Configuration selection as a route towards efficient vibrational configuration interaction calculations Guntram Rauhut The Journal of Chemical Physics Configuration SelectionEngineeringComputational ChemistryStructural OptimizationComputational Mechanics	2007	124

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