Keiji Morokuma - Concepedia

Author

Keiji Morokuma

Also Known As

K MOROKUMA, K Morokuma, K. MOROKUMA, K. Morokuma, K. Moroküma, KEIJI MOROKUMA, Keiji MOROKUMA, Keiji Morokuma, Keiji. Morokuma, Morokuma, K.

1.1K

Publications

60.8K

Citations

108

H-Index

252

Concepts

All Affiliations

Emory University Atlanta University Center Emerson (United States)Kyoto University Institute for Molecular Science

About

Keiji Morokuma is an author at Emory University specializing in engineering, chemistry, and natural sciences.

Top Concepts

#	Concept	H-Index	Publications	Citations
1	Engineering	99	515	42.9K
2	Health Sciences	4	4	204
3	Arts	2	2	115
4	Language Studies	2	2	40
5	Education	1	1	12

Keiji Morokuma

705

Publications

55.8K

Citations

107

H-Index

Page 1

	Year	Citations
A new energy decomposition scheme for molecular interactions within the Hartree‐Fock approximation Kazuo Kitaura, Keiji Morokuma International Journal of Quantum Chemistry Supermolecule Molecular OrbitalsEngineeringPhysicsNatural SciencesMolecular Interaction Energy	1976	2.1K
A new ONIOM implementation in Gaussian98. Part I. The calculation of energies, gradients, vibrational frequencies and electric field derivatives Stefan Dapprich, István Komáromi, K. Suzie Byun, Journal of Molecular Structure THEOCHEM Numerical AnalysisNumerical ComputationEngineeringPhysicsValidated Numerics	1999	2.1K
ONIOM: A Multilayered Integrated MO + MM Method for Geometry Optimizations and Single Point Energy Predictions. A Test for Diels−Alder Reactions and Pt(P(<i>t</i>-Bu)<sub>3</sub>)<sub>2</sub> + H<sub>2</sub> Oxidative Addition Mats Svensson, Stéphane Humbel, Robert D. J. Froese, The Journal of Physical Chemistry EngineeringTheoretical Inorganic ChemistryMolecular OrbitalComputational ChemistryChemistry	1996	1.9K
Molecular Orbital Studies of Hydrogen Bonds. III. C=O···H–O Hydrogen Bond in H2CO···H2O and H2CO···2H2O Keiji Morokuma The Journal of Chemical Physics	1971	1.9K
IMOMM: A new integrated <i>ab initio</i> + molecular mechanics geometry optimization scheme of equilibrium structures and transition states Feliu Maseras, Keiji Morokuma Journal of Computational Chemistry Transition StatesEngineeringPhysicsNatural SciencesMolecular Mechanics Descriptions	1995	1.7K
Why do molecules interact? The origin of electron donor-acceptor complexes, hydrogen bonding and proton affinity Keiji Morokuma Accounts of Chemical Research EngineeringChemical AnalysisProton AffinityProton-coupled Electron TransferAltmetric Attention Score	1977	973
Combining Quantum Mechanics Methods with Molecular Mechanics Methods in ONIOM Thom Vreven, K. Suzie Byun, István Komáromi, Journal of Chemical Theory and Computation Electronic EmbeddingEngineeringComputational ChemistryChemistryElectronic Structure	2006	951
The intrinsic reaction coordinate. An <i>a</i> <i>b</i> <i>i</i> <i>n</i> <i>i</i> <i>t</i> <i>i</i> <i>o</i> calculation for HNC→HCN and H−+CH4→CH4+H− Kazuhiro Ishida, Keiji Morokuma, Andrew Komornicki The Journal of Chemical Physics EngineeringIntrinsic Reaction CoordinateBiochemistryEnergy GradientNatural Sciences	1977	863
The IMOMO method: Integration of different levels of molecular orbital approximations for geometry optimization of large systems: Test for <i>n</i>-butane conformation and <i>S</i> <i>N</i>2 reaction: RCl+Cl− Stéphane Humbel, Stefan Sieber, Keiji Morokuma The Journal of Chemical Physics EngineeringTheoretical Inorganic ChemistryMolecular OrbitalComputational ChemistryChemistry	1996	668
The origin of hydrogen bonding. An energy decomposition study Hideaki Umeyama, Keiji Morokuma Journal of the American Chemical Society Chemical EngineeringMolecular SciencesEngineeringChemical AnalysisNatural Sciences	1977	639

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