A fundamental approach to compute atomic electrophilicity index (Q2201051)
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scientific article; zbMATH DE number 7251563
| Language | Label | Description | Also known as |
|---|---|---|---|
| default for all languages | No label defined |
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| English | A fundamental approach to compute atomic electrophilicity index |
scientific article; zbMATH DE number 7251563 |
Statements
A fundamental approach to compute atomic electrophilicity index (English)
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24 September 2020
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density functional theory (DFT)
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electron affinity
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electrophilicity equalization principle (EEP)
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ionization energy
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periodicity
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0.7505428791046143
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0.7425246238708496
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0.6697021722793579
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0.6483588218688965
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0.6445236802101135
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