Computational Chemistry: Reviews of Current Trends
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Abstract
One-Electron Equations for Embedded Electron Density: Challenge for Theory and Practical Payoffs in Multi-Level Modeling of Complex Polyatomic Systems (T A Wesolowski) Density-Functional Based Investigation of Molecular Magnets (M R Pederson et al.) Vibrational Spectra by Electron Impact: Theoretical Models for Intensities (P arsky & R urik) Theoretical Description of the Kinetics of Gas-Phase Reactions Important in Atmospheric Chemistry (J T Jodkowski) Predicting and Understanding the Signs of One- and Two-Bond Spin-Spin Coupling Constants across X-H-Y Hydrogen Bonds (J E Del Bene & J Elguero) Towards the Elucidation of the Activation of Cisplatin in Anticancer Treatment (J V Burda et al.).
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760
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- 19.96
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- 100%
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Authors
1Topics & keywords
Keywords
- Polyatomic ion
- Molecular magnets
- Electron density
- Density functional theory
- Chemistry
- Hydrogen bond
- Computational chemistry
- Spin (aerodynamics)
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