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http://nopr.niscpr.res.in/handle/123456789/13358Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Chakraborty, Arindam | - |
| dc.contributor.author | Duley, Soma | - |
| dc.contributor.author | Chattaraj, Pratim K | - |
| dc.date.accessioned | 2012-01-08T05:38:43Z | - |
| dc.date.available | 2012-01-08T05:38:43Z | - |
| dc.date.issued | 2012-01 | - |
| dc.identifier.issn | 0975-0975(Online); 0376-4710(Print) | - |
| dc.identifier.uri | http://hdl.handle.net/123456789/13358 | - |
| dc.description | 226-244 | en_US |
| dc.description.abstract | Importance of various conceptual density functional theory based reactivity descriptors and nucleus independent chemical shift in analyzing the hydrogen adsorption potential of a wide variety of systems is reviewed. The charges on the different atomic sites in a molecule also play a crucial role in this regard. | en_US |
| dc.language.iso | en_US | en_US |
| dc.publisher | NISCAIR-CSIR, India | en_US |
| dc.rights |  CC Attribution-Noncommercial-No Derivative Works 2.5 India | en_US |
| dc.source | IJC-A Vol.51A(01-02) [January-February 2012] | en_US |
| dc.subject | Theoretical chemistry | en_US |
| dc.subject | Density functional calculations | en_US |
| dc.subject | Hydrogen storage | en_US |
| dc.subject | Aromaticity | en_US |
| dc.subject | Conceptual DFT | en_US |
| dc.subject | Nucleus independent chemical shift | en_US |
| dc.subject | Chemical shift | en_US |
| dc.title | Hydrogen storage: An overview with current insights based on a conceptual DFT approach | en_US |
| dc.type | Article | en_US |
| Appears in Collections: | IJC-A Vol.51A(01-02) [January-February 2012] | |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| IJCA 51A(01-02) 226-244.pdf | 524.28 kB | Adobe PDF | View/Open |
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