libvdwxc: A library for exchange–correlation functionals in the vdW-DF family AH Larsen, M Kuisma, J Löfgren, Y Pouillon, P Erhart, P Hyldgaard Modelling and Simulation in Materials Science and Engineering 25 (6), 065004, 2017 | 40 | 2017 |
Understanding the phase diagram of self-assembled monolayers of alkanethiolates on gold J Löfgren, H Grönbeck, K Moth-Poulsen, P Erhart The Journal of Physical Chemistry C 120 (22), 12059-12067, 2016 | 32 | 2016 |
Machine learning optimization of lignin properties in green biorefineries J Lofgren, D Tarasov, T Koitto, P Rinke, M Balakshin, M Todorovic ACS Sustainable Chemistry & Engineering 10 (29), 9469-9479, 2022 | 19 | 2022 |
A tale of two phase diagrams: Interplay of ordering and hydrogen uptake in Pd–Au–H JM Rahm, J Löfgren, E Fransson, P Erhart Acta Materialia 211, 116893, 2021 | 19 | 2021 |
Electric-field-controlled reversible order-disorder switching of a metal tip surface L de Knoop, M Juhani Kuisma, J Löfgren, K Lodewijks, M Thuvander, ... Physical Review Materials 2 (8), 085006, 2018 | 15 | 2018 |
Understanding interactions driving the template-directed self-assembly of colloidal nanoparticles at surfaces J Eklöf-Österberg, J Löfgren, P Erhart, K Moth-Poulsen The Journal of Physical Chemistry C 124 (8), 4660-4667, 2020 | 8 | 2020 |
Computational assessment of the efficacy of halides as shape-directing agents in nanoparticle growth J Löfgren, JM Rahm, J Brorsson, P Erhart Physical Review Materials 4 (9), 096001, 2020 | 7 | 2020 |
Quantitative predictions of thermodynamic hysteresis: Temperature-dependent character of the phase transition in Pd–H JM Rahm, J Löfgren, P Erhart Acta Materialia 227, 117697, 2022 | 6 | 2022 |
Modeling colloidal nanoparticles: from growth to deposition J Löfgren PQDT-Global, 2019 | 4 | 2019 |
Electric Field-Induced Surface Melting of Gold Observed In Situ at Room Temperature and at Atomic Resolution Using TEM L de Knoop, MJ Kuisma, J Löfgren, K Lodewijks, M Thuvander, P Erhart, ... Microscopy and Microanalysis 25 (S2), 1830-1831, 2019 | 2 | 2019 |
The Monte Carlo Method and Quantum Path Integrals J Löfgren Chalmers University of Technology, 2014 | 2 | 2014 |
Elements of modeling nanoparticle growth: Surface thermodynamics and dispersive interactions J Löfgren Chalmers University of Technology, 2017 | 1 | 2017 |
AI-guided biorefinery optimization for the production of lignin-carbohydrate complexes with tailored properties D Diment, J Löfgren, M Alopaeus, M Stosiek, MJ Cho, C Xu, M Hummel, ... | | 2024 |
Quantitative predictions of thermodynamic hysteresis: Temperature-dependent character of the phase transition in Pd-H J Magnus Rahm, J Löfgren, P Erhart arXiv e-prints, arXiv: 2110.07883, 2021 | | 2021 |
A tale of two phase diagrams: Interplay of ordering and hydrogen uptake in Pd-Au-H J Magnus Rahm, J Löfgren, E Fransson, P Erhart arXiv e-prints, arXiv: 2103.14340, 2021 | | 2021 |
Configuration Interaction Methods and Large-scale Matrix Diagonalization P Hansson, J Löfgren, KS Keiding, S Vajedi | | 2012 |