Number of items: 4.
Ghiringhelli, Luca M.,
Baldauf, Carsten,
Bereau, Tristan,
Brockhauser, Sandor,
Carbogno, Christian,
Chamanara, Javad,
Cozzini, Stefano,
Curtarolo, Stefano,
Draxl, Claudia,
Dwaraknath, Shyam et al.
(2023)
Shared metadata for data-centric materials science.
Scientific Data, 10
(1).
626.
doi:
10.1038/s41597-023-02501-8
ISSN 2052-4463.
Zhang, Liwei, Onat, Berk, Dusson, Geneviève, McSloy, Adam, Anand, G., Maurer, Reinhard J., Ortner, Christoph and Kermode, James R.
(2022)
Equivariant analytical mapping of first principles Hamiltonians to accurate and transferable materials models.
npj Computational Materials, 8
(1).
158.
doi:10.1038/s41524-022-00843-2
ISSN 2057-3960.
Onat, Berk, Ortner, Christoph and Kermode, James R.
(2020)
Sensitivity and dimensionality of atomic environment representations used for machine learning interatomic potentials.
The Journal of Chemical Physics, 153
(14).
144106.
doi:10.1063/5.0016005
ISSN 0021-9606.
Ansari, Narjes, Onat, Berk, Sosso, Gabriele C. and Hassanali, Ali
(2020)
Insights into the emerging networks of voids in simulated supercooled water.
The Journal of Physical Chemistry B, 124
(11).
pp. 2180-2190.
doi:10.1021/acs.jpcb.9b10144
ISSN 1520-6106.
This list was generated on Fri Mar 29 11:02:22 2024 GMT.