Michael J. Frisch

According to our database1, Michael J. Frisch authored at least 14 papers between 1972 and 2021.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of four.

Timeline

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Bibliography

2021
Assessing challenging intra- and inter-molecular charge-transfer excitations energies with double-hybrid density functionals.
J. Comput. Chem., 2021

Cover Image.
J. Comput. Chem., 2021

2020
Double hybrids and time-dependent density functional theory: An implementation and benchmark on charge transfer excited states.
J. Comput. Chem., 2020

2018
How are the charge transfer descriptors affected by the quality of the underpinning electronic density?
J. Comput. Chem., 2018

2016
Modeling emission features of salicylidene aniline molecular crystals: A QM/QM' approach.
J. Comput. Chem., 2016

2011
Modelling the Runtime of the Gaussian Computational Chemistry Application and Assessing the Impacts of Microarchitectural Variations.
Proceedings of the International Conference on Computational Science, 2011

2009
Scalability of Gaussian 03 on SGI Altix: The Importance of Data Locality on CC-NUMA Architecture.
Proceedings of the Evolving OpenMP in an Age of Extreme Parallelism, 2009

2007
On the Use of Incomplete LU Decomposition as a Preconditioning Technique for Density Fitting in Electronic Structure Computations.
Proceedings of the Computational Science and Its Applications, 2007

2003
Geometry optimization with QM/MM, ONIOM, and other combined methods. I. Microiterations and constraints.
J. Comput. Chem., 2003

2000
Ab initio quantum chemistry on a ccNUMA architecture using openMP III.
Parallel Comput., 2000

1998
Ab initio quantum chemistry on the Cray T3E massively parallel supercomputer: II.
J. Comput. Chem., 1998

1996
Using redundant internal coordinates to optimize equilibrium geometries and transition states.
J. Comput. Chem., 1996

1995
Ab Initio Calculation of Molar Volumes: Compariso with Experiment and Use in Solvation Models.
J. Comput. Chem., 1995

1972
Remarks on Characteristic Values and Associated Solutions of Mathieus Differential Equation, Exponential Integral, and Systems of Hyperbolic P.D.E. (Remark on Algorithms 352, 385, 392).
Commun. ACM, 1972


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