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Comprehensive Thermochemical Benchmark Set of Realistic Closed-Shell Metal Organic Reactions | Journal of Chemical Theory and Computation
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Regularized Second-Order Møller–Plesset Theory: A More Accurate Alternative to Conventional MP2 for Noncovalent Interactions and Transition Metal Thermochemistry for the Same Computational Cost | The Journal of Physical Chemistry Letters
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![PDF] Dynamics and the failure of transition state theory in alkene hydroboration. | Semantic Scholar](https://d3i71xaburhd42.cloudfront.net/3863d01b7aab10887a225820e4913586ce0474bb/1-Table1-1.png "PDF] Dynamics and the failure of transition state theory in alkene hydroboration. | Semantic Scholar")
PDF] Dynamics and the failure of transition state theory in alkene hydroboration. | Semantic Scholar
Incremental CCSD(T)(F12*)|MP2: A Black Box Method To Obtain Highly Accurate Reaction Energies | Journal of Chemical Theory and Computation
Correlated Ab Initio Calculations: Tutorial and Assignments
Dispersion Energy from the Time-Independent Coupled-Cluster Polarization Propagator | Journal of Chemical Theory and Computation
Møller–Plesset perturbation theory: from small molecule methods to methods for thousands of atoms - Cremer - 2011 - WIREs Computational Molecular Science - Wiley Online Library
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Response Calculations within Time-Dependent Density Functional ...
Different CCSD correlation energies between TCE and legacy CCSD code · Issue #117 · nwchemgit/nwchem · GitHub
The calculated binding energies in cm 1 ) at the MP2 , MP3 , MP4 , CCSD... | Download Scientific Diagram
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Double‐hybrid density functionals - Goerigk - 2014 - WIREs Computational Molecular Science - Wiley Online Library
Accurate Ionization Potentials and Electron Affinities of Acceptor Molecules I. Reference Data at the CCSD(T) Complete Basis Set Limit | Journal of Chemical Theory and Computation
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The calculated binding energies in cm 1 ) at the MP2 , MP3 , MP4 , CCSD... | Download Scientific Diagram
Walltime for the CCSD(T) calculation of total energy of (H 2 O) 20 as a... | Download Scientific Diagram
1 Multicomponent MP4 and the inclusion of triple excitations in multicomponent many- body methods O. Jonathan Fajen, Kurt R. Bro
Performance of Property-Optimized Basis Sets for Optical Rotation with Coupled Cluster Theory | The Journal of Physical Chemistry A
ALDA and VK static axial polarizability of hydrogen chains compared... | Download Scientific Diagram
