CLOPPA−IPPP Analysis of Cooperative Effects in H-Bonded Molecular Complexes. 2. Application to the Static Molecular Polarizability Tensor
Author:
Affiliation:
1. Department of Physics, Facultad de Ciencias Exactas y Naturales, University of Buenos Aires, Ciudad Universitaria, Pab. I, (1428) Buenos Aires, Argentina
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp909221a
Reference56 articles.
1. The Crystalline Enol of 1,3-Cyclohexanedione and Its Complex with Benzene: Vibrational Spectra, Simulation of Structure and Dynamics and Evidence for Cooperative Hydrogen Bonding
2. Cooperative Effects: Stabilization of the Isoguanine Trimer
3. Cooperative effects in hydrogen-bonding of protein secondary structure elements: A systematic analysis of crystal data using Secbase
4. Sequence-space selection of cooperative model proteins
5. Interaction Energies and NMR Indirect Nuclear Spin−Spin Coupling Constants in Linear HCN and HNC Complexes
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1. IPPP-CLOPPA Analysis of the Influence of the Methylation on the Potential Energy and the Molecular Polarizability of the Hydrogen Bonds in the Cytosine–Guanine Base Pair;The Journal of Physical Chemistry A;2017-04-05
2. Benchmark, DFT assessments, cooperativity, and energy decomposition analysis of the hydrogen bonds in HCN/HNC oligomeric complexes;Journal of Molecular Modeling;2017-02
3. CLOPPA Analysis of the Molecular Polarizability and the Energy of Strong Intramolecular Hydrogen Bonds: Resonance Assisted?;The Journal of Physical Chemistry A;2012-11-30
4. Large Changes of Static Electric Properties Induced by Hydrogen Bonding: An ab Initio Study of Linear HCN Oligomers;The Journal of Physical Chemistry A;2011-04-14
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