Mezei, Pál Dániel and Csonka, Gábor I. and Kállay, Mihály (2017) Electron density errors and density-driven exchange-correlation energy errors in approximate density functional calculations. JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 13. pp. 1-21. ISSN 1549-9618
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acs.jctc.7b00550.pdf Download (904kB) | Preview |
Official URL: https://doi.org/10.1021/acs.jctc.7b00550
| Item Type: | Article |
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| Subjects: | Q Science / természettudomány > QD Chemistry / kémia > QD01 Analytical chemistry / analitikai kémia |
| SWORD Depositor: | MTMT SWORD |
| Depositing User: | MTMT SWORD |
| Date Deposited: | 12 Sep 2017 14:15 |
| Last Modified: | 30 Sep 2018 23:15 |
| URI: | http://real.mtak.hu/id/eprint/62300 |
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