Barcza, Gergely and Ivády, Viktor and Szilvási, Tibor and Vörös, Márton and Veis, Libor and Gali, Ádám and Legeza, Örs (2021) DMRG on top of plane-wave Kohn-Sham orbitals: case study of defected boron nitride. JOURNAL OF CHEMICAL THEORY AND COMPUTATION. ISSN 1549-9618
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paper_DFT-DMRG_jctc_accept.pdf Download (1MB) | Preview |
Official URL: https://doi.org/10.1021/acs.jctc.0c00809
| Item Type: | Article |
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| Subjects: | Q Science / természettudomány > QC Physics / fizika > QC06 Physics of condensed matter / szilárdtestfizika |
| Depositing User: | Barcza Gergely |
| Date Deposited: | 28 Sep 2021 06:49 |
| Last Modified: | 28 Sep 2021 06:49 |
| URI: | http://real.mtak.hu/id/eprint/130729 |
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