DEVELOPMENT OF LOCAL NEURAL-NETWORK KHON-SHAM EXCHANGE FUNCTIONAL METHODS IN MOLECULES
Development exchange functional Ex is generally based on a general strategy that is often referred to as Jacobs Ladder, where for increased accuracy of the function Ex involves KS orbitals and derivative of electron density with respect to space. Various functions of Ex with varying accuracy are w...
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| Format: | Theses |
| Language: | Indonesia |
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| Online Access: | https://digilib.itb.ac.id/gdl/view/33162 |
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| Institution: | Institut Teknologi Bandung |
| Language: | Indonesia |