| The Hiphive Package for the Extraction of High‐Order Force Constants by Machine Learning F Eriksson, E Fransson, P Erhart Advanced Theory and Simulations 2 (5), 1800184, 2019 | 367 | 2019 |
| Extremely anisotropic van der Waals thermal conductors SE Kim, F Mujid, A Rai, F Eriksson, J Suh, P Poddar, A Ray, C Park, ... Nature 597 (7878), 660-665, 2021 | 233 | 2021 |
| ICET–A Python library for constructing and sampling alloy cluster expansions M Ångqvist, WA Muñoz, JM Rahm, E Fransson, C Durniak, P Rozyczko, ... Advanced Theory and Simulations 2 (7), 1900015, 2019 | 188 | 2019 |
| A Solution‐Doped Polymer Semiconductor: Insulator Blend for Thermoelectrics D Kiefer, L Yu, E Fransson, A Gómez, D Primetzhofer, A Amassian, ... Advanced Science 4 (1), 1600203, 2017 | 100 | 2017 |
| Efficient construction of linear models in materials modeling and applications to force constant expansions E Fransson, F Eriksson, P Erhart npj Computational Materials 6 (1), 135, 2020 | 50 | 2020 |
| dynasor—A Tool for Extracting Dynamical Structure Factors and Current Correlation Functions from Molecular Dynamics Simulations E Fransson, M Slabanja, P Erhart, G Wahnström Advanced Theory and Simulations 4 (2), 2000240, 2021 | 45 | 2021 |
| Efficient Calculation of the Lattice Thermal Conductivity by Atomistic Simulations with Ab Initio Accuracy J Brorsson, A Hashemi, Z Fan, E Fransson, F Eriksson, T Ala‐Nissila, ... Advanced Theory and Simulations, 2100217, 2021 | 37 | 2021 |
| Limits of the phonon quasi-particle picture at the cubic-to-tetragonal phase transition in halide perovskites E Fransson, P Rosander, F Eriksson, JM Rahm, T Tadano, P Erhart Communications Physics 6 (1), 173, 2023 | 34* | 2023 |
| Atomicrex—a general purpose tool for the construction of atomic interaction models A Stukowski, E Fransson, M Mock, P Erhart Modelling and Simulation in Materials Science and Engineering 25 (5), 055003, 2017 | 33 | 2017 |
| Phase transitions in inorganic halide perovskites from machine-learned potentials E Fransson, J Wiktor, P Erhart The Journal of Physical Chemistry C 127 (28), 13773-13781, 2023 | 32 | 2023 |
| Complexions and grain growth retardation: First-principles modeling of phase boundaries in WC-Co cemented carbides at elevated temperatures E Fransson, M Gren, G Wahnström Acta Materialia 216, 117128, 2021 | 29 | 2021 |
| Quantifying Dynamic Tilting in Halide Perovskites: Chemical Trends and Local Correlations J Wiktor, E Fransson, D Kubicki, P Erhart Chemistry of Materials 35 (17), 6737-6744, 2023 | 23 | 2023 |
| 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 | 21 | 2021 |
| Tuning the through-plane lattice thermal conductivity in van der Waals structures through rotational (dis) ordering F Eriksson, E Fransson, C Linderälv, Z Fan, P Erhart ACS nano 17 (24), 25565-25574, 2023 | 19 | 2023 |
| Thermal conductivity in intermetallic clathrates: A first-principles perspective DO Lindroth, J Brorsson, E Fransson, F Eriksson, A Palmqvist, P Erhart Physical Review B 100 (4), 045206, 2019 | 18 | 2019 |
| Defects from phonons: Atomic transport by concerted motion in simple crystalline metals E Fransson, P Erhart Acta Materialia 196, 770-775, 2020 | 17 | 2020 |
| Modeling of vibrational and configurational degrees of freedom in hexagonal and cubic tungsten carbide at high temperatures M Gren, E Fransson, M Ångqvist, P Erhart, G Wahnström Physical Review Materials 5 (3), 033804, 2021 | 16 | 2021 |
| Revealing the Free Energy Landscape of Halide Perovskites: Metastability and Transition Characters in CsPbBr3 and MAPbI3 E Fransson, JM Rahm, J Wiktor, P Erhart Chemistry of Materials 35 (19), 8229-8238, 2023 | 11 | 2023 |
| A computational study of the temperature dependence of interface and surface energies in WC–Co cemented carbides MA Gren, E Fransson, G Wahnström International Journal of Refractory Metals and Hard Materials 87, 105114, 2020 | 11 | 2020 |
| calorine: A Python package for constructing and sampling neuroevolution potential models E Lindgren, M Rahm, E Fransson, F Eriksson, N Österbacka, Z Fan, ... Journal of Open Source Software 9 (95), 6264, 2024 | 9 | 2024 |
Paul ErhartProfessor of Physics, Chalmers University of TechnologyVerifisert e-postadresse på chalmers.se
