Parallel implementation of the equation-of-motion coupled-cluster singles and doubles method and application for radical adducts of cytosine
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.3091293
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1. SHORT COMMUNICATION: Infrequent alterations of the p53 gene in rat skin cancers induced by ionizing radiation
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3. Hybrid coupled cluster and molecular dynamics approach: Application to the excitation spectrum of cytosine in the native DNA environment
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2. Efficient Implementation of Equation-of-Motion Coupled-Cluster Singles and Doubles Method with the Density-Fitting Approximation: An Enhanced Algorithm for the Particle–Particle Ladder Term;Journal of Chemical Theory and Computation;2022-02-02
3. Many-Body Quantum Chemistry on Massively Parallel Computers;Chemical Reviews;2020-12-11
4. Scalable Electron Correlation Methods. 4. Parallel Explicitly Correlated Local Coupled Cluster with Pair Natural Orbitals (PNO-LCCSD-F12);Journal of Chemical Theory and Computation;2017-09-28
5. Massively Parallel Implementation of Explicitly Correlated Coupled-Cluster Singles and Doubles Using TiledArray Framework;The Journal of Physical Chemistry A;2016-12-14
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