2018年6期
刊物介紹
《物理化學(xué)學(xué)報(bào)》由中國(guó)科學(xué)技術(shù)協(xié)會(huì)主管、中國(guó)化學(xué)會(huì)主辦，綜合因子為：1.119，被北大核心期刊、CSCD核心期刊、統(tǒng)計(jì)源期刊收錄。物理化學(xué)學(xué)報(bào)主要刊載化學(xué)學(xué)科物理化學(xué)領(lǐng)域具有原創(chuàng)性實(shí)驗(yàn)和基礎(chǔ)理論研究類(lèi)文章。
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論文 ARTICLE
- Levy Constrained Search in Fock Space:An Alternative Approach to Noninteger Electron Number
- Understanding Chemical Reactivity in Extended Systems: Exploring Models of Chemical Softness in Carbon Nanotubes
- Aromaticity Study of Benzene-Fused Fulvene Derivatives Using the Information-Theoretic Approach in Density Functional Reactivity Theory
- The Infl uence of the Exchange-Correlation Functional on the Non-Interacting Kinetic Energy and Its Implications for Orbital-Free Density Functional Approximations
- Kohn-Sham Density Matrix and the Kernel Energy Method
- Quantitative Electrophilicity Measures
- Multiply Charged Anions, Maximum Charge Acceptance, and Higher Electron Affinities of Molecules, Superatoms, and Clusters
- Thermodynamic Dual Descriptor
- Reactivity of Indoles through the Eyes of a Charge-Transfer Partitioning Analysis
- Analogies between Density Functional Theory Response Kernels and Derivatives of Thermodynamic State Functions
- Synthesis of Mn O x-CeO2 Using Metal-Organic Framework as Sacrificial Template and Its Performance in the Toluene Catalytic Oxidation Reaction