Please use this identifier to cite or link to this item:
https://dspace.iiti.ac.in/handle/123456789/1783
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.advisor | Bulusu, Satya S. | - |
| dc.contributor.author | Mandal, Aniket | - |
| dc.date.accessioned | 2019-08-21T10:26:38Z | - |
| dc.date.available | 2019-08-21T10:26:38Z | - |
| dc.date.issued | 2019-07-03 | - |
| dc.identifier.uri | https://dspace.iiti.ac.in/handle/123456789/1783 | - |
| dc.description.abstract | Ab Initio Quantum Chemistry methods are used in Theoretical and Computational Chemistry for a variety of purposes. They are primarily used to calculate the electronic energy of a system. In this project, we used one such ab initio method, the Hartree-Fock method, to calculate the electronic energy of two systems, H2O and HeH+. | en_US |
| dc.language.iso | en | en_US |
| dc.publisher | Department of Chemistry, IIT Indore | en_US |
| dc.relation.ispartofseries | MS136 | - |
| dc.subject | Chemistry | en_US |
| dc.title | Energy computations using Hartree-Fock method | en_US |
| dc.type | Thesis_M.Sc | en_US |
| Appears in Collections: | Department of Chemistry_ETD | |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| MS_136_Aniket_Mandal_1703131002.pdf | 564.1 kB | Adobe PDF |  View/Open |
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