Manzhos, S. - Golub, Pavlo
Data-driven kinetic energy density fitting for orbital-free DFT: Linear vs Gaussian process regression.
Journal of Chemical Physics. Roč. 153, č. 7 (2020), č. článku 074104. ISSN 0021-9606. E-ISSN 1089-7690
OECD category: Physical chemistry
Impact factor: 3.488, year: 2020 ; AIS: 0.833, rok: 2020
Method of publishing: Open access
DOI: https://doi.org/10.1063/5.0015042
http://hdl.handle.net/11104/0315897