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Figure 2 from Structure and binding energy of the H2S dimer at the CCSD(T) complete basis set limit. | Semantic Scholar
Molecules | Free Full-Text | Toward Exploring Novel Organic Materials: MP4-DFT Properties of 4-Amino-3-Iminoindene | HTML
Computerized implementation of higher‐order electron‐correlation methods and their linear‐scaling divide‐and‐conquer extensions - Nakano - 2017 - Journal of Computational Chemistry - Wiley Online Library
Application of a convergent, composite coupled cluster approach to bound state, adiabatic electron affinities in atoms and small molecules: The Journal of Chemical Physics: Vol 144, No 1
Pro®le diagrams of the di erence electron density distribution ¢»…r † ˆ... | Download Scientific Diagram
Benchmark theoretical study of the electric polarizabilities of naphthalene, anthracene, and tetracene: The Journal of Chemical Physics: Vol 138, No 2
PDF] Convergence of the Møller-Plesset perturbation series for the fcc lattices of neon and argon | Semantic Scholar
Figure 3 from Structure and binding energy of the H2S dimer at the CCSD(T) complete basis set limit. | Semantic Scholar
Figure 4 from Structure and binding energy of the H2S dimer at the CCSD(T) complete basis set limit. | Semantic Scholar
Levels of symmetry adapted perturbation theory (SAPT). I. Efficiency and performance for interaction energies: The Journal of Chemical Physics: Vol 140, No 9
ELECTRONIC STRUCTURE THEORY Navigating Chemical Compound Space - ppt download
Fragment molecular orbital (FMO) calculations on DNA by a scaled third-order Møller-Plesset perturbation (MP2.5) scheme - ScienceDirect
Efficient prediction for high precision CO‐N2 potential energy surface by stacking ensemble DNN - Xu - - Journal of Computational Chemistry - Wiley Online Library
The calculated binding energies in cm 1 ) at the MP2 , MP3 , MP4 , CCSD... | Download Scientific Diagram
Full article: Electronic spectroscopy of some small anions containing S, N and O using CR-EOM-CCSD(T) method
Molecules | Free Full-Text | Toward Exploring Novel Organic Materials: MP4-DFT Properties of 4-Amino-3-Iminoindene | HTML
On the applicability of the MP2.5 approximation for open-shell systems. Case study of atmospheric reactivity - ScienceDirect
Benchmarking Quantum Chemical Methods: Are We Heading in the Right Direction? - Mata - 2017 - Angewandte Chemie International Edition - Wiley Online Library
Ab initio correlation functionals from second-order perturbation theory: The Journal of Chemical Physics: Vol 125, No 10
Molecules | Free Full-Text | Relationships between Interaction Energy and Electron Density Properties for Homo Halogen Bonds of the [(A)nY–X···X–Z(B)m] Type (X = Cl, Br, I) | HTML
Statistical molecular fragmentation: which parameters influence the branching ratios? - Physical Chemistry Chemical Physics (RSC Publishing)
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) 18 as a... | Download Scientific Diagram
Scaled MP3 Non‐Covalent Interaction Energies Agree Closely with Accurate CCSD(T) Benchmark Data - Pitoňák - 2009 - ChemPhysChem - Wiley Online Library
On the applicability of the MP2.5 approximation for open-shell systems. Case study of atmospheric reactivity - ScienceDirect