No photo of Susi Lehtola
  • PB 55 (A. I. Virtanens plats 1)

    00014

    Finland

20102019
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Personal profile

Keywords

  • 114 Physical sciences
  • Inelastic X-ray scattering
  • 116 Chemical sciences
  • Quantum chemistry

International and National Collaboration Publications and projects within past five years.

Publications 2010 2019

Assessment of Initial Guesses for Self-Consistent Field Calculations. Superposition of Atomic Potentials: Simple yet Efficient

Lehtola, S., Mar 2019, In : Journal of Chemical Theory and Computation. 15, 3, p. 1593-1604 12 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
File

Fully numerical electronic structure calculations on diatomic molecules in weak to strong magnetic fields

Lehtola, S., Dimitrova, M. & Sundholm, D., 30 Mar 2019, In : Molecular Physics. 13 p., 1597989.

Research output: Contribution to journalArticleScientificpeer-review

Stretched or noded orbital densities and self-interaction correction in density functional theory

Shahi, C., Bhattarai, P., Wagle, K., Santra, B., Schwalbe, S., Hahn, T., Kortus, J., Jackson, K. A., Peralta, J. E., Trepte, K., Lehtola, S., Nepal, N. K., Myneni, H., Neupane, B., Adhikari, S., Ruzsinszky, A., Yamamoto, Y., Baruah, T., Zope, R. R. & Perdew, J. P., 7 May 2019, In : Journal of Chemical Physics. 150, 17, 8 p., 174102.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
File

Recent developments in LIBXC — A comprehensive library of functionals for density functional theory

Lehtola, S., Steigemann, C., Oliveira, M. J. T. & Marques, M. A. L., 2018, In : SoftwareX. 7, p. 1-5 5 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
File

Automatic Algorithms for Completeness-Optimization of Gaussian Basis Sets

Lehtola, S., 15 Feb 2015, In : Journal of Computational Chemistry. 36, 5, p. 335-347 13 p.

Research output: Contribution to journalArticleScientificpeer-review

Projects 2011 2011

Materials- and Nanophysics Researcher Community (MATENA)

Ahlgren, T., Aitola, K., Arstila, K., Avchachov, K., Björkas, C., Chrobak, D., Costelle, L., Djurabekova, F., Fernandez Martinez, M., Galambosi, S., Hakala, M., Harjunmaa, A. N., Heinola, K., Hirvelä, J. H., Holmström, E. K., Huotari, S., Hämäläinen, K., Ikonen, T., Jalkanen, P., Jansson, V., Juurinen, I., Keinonen, J., Keyriläinen, J., Kisko, K., Koskelo, O., Krasheninnikov, A., Kuronen, A., Lasa Esquisabel, A., Laukkanen, J. K., Lehtinen, O. J., Lehtola, S., Leppänen, K., Mattila, A., Meinander, N. K., Mizohata, K., Nordlund, K., Nygård, K., Pakarinen, O. H., Palonen, V., Parviainen, S., Peura, M., Pirkkalainen, K., Pirojenko, A., Pohjonen, A., Polvi, J., Porra, L., Pusa, P., Pylkkänen, T., Rauhala, E., Ruotsalainen, K., Ruzibaev, A., Räisänen, J., Sajavaara, T. P., Sakko, A., Serimaa, R., Soininen, A., Suhonen, H., Timko, H., Tolvanen, A., Torkkeli, M., Tuboltsev, V., Ullah, M., Väyrynen, S. & Vörtler, K.

22/02/2011 → …

Project: Research Evaluation 2011

Prizes

Löwdin postdoctoral award

Susi Lehtola (Recipient), 2017

Prize: Prizes and awards

Activities 2018 2018

  • 2 Academic visit to other institution

ETH Zurich

Susi Samuli Lehtola (Visiting researcher)
1 Sep 201830 Nov 2018

Activity: Visiting an external institution typesAcademic visit to other institution

University of Oslo

Susi Samuli Lehtola (Visiting researcher)
5 Jun 201831 Jul 2018

Activity: Visiting an external institution typesAcademic visit to other institution