| GPAW: An open Python package for electronic structure calculations JJ Mortensen, AH Larsen, M Kuisma, AV Ivanov, A Taghizadeh, ... The Journal of Chemical Physics 160 (9), 2024 | 35 | 2024 |
| Atomic scale characterization of fluxional cation behavior on nanoparticle surfaces: probing oxygen vacancy creation/annihilation at surface sites EL Lawrence, BDA Levin, T Boland, SLY Chang, PA Crozier ACS nano 15 (2), 2624-2634, 2021 | 28 | 2021 |
| Computational synthesis of 2D materials: A high-throughput approach to materials design TM Boland, AK Singh Computational Materials Science 207, 111238, 2022 | 14 | 2022 |
| Atomic-resolution mapping of localized phonon modes at grain boundaries B Haas, TM Boland, C Elsässer, AK Singh, K March, J Barthel, CT Koch, ... Nano letters 23 (13), 5975-5980, 2023 | 12 | 2023 |
| Impact of Aliovalent Alkaline-Earth metal solutes on Ceria Grain Boundaries: A density functional theory study TM Boland, P Rez, PA Crozier, AK Singh Acta Materialia 205, 116481, 2021 | 10 | 2021 |
| Identification of rapid oxygen exchange through site-dependent cationic displacements on CeO2 nanoparticles EL Lawrence, BDA Levin, TM Boland, SLY Chang, PA Crozier Microscopy and Microanalysis 24 (S1), 54-55, 2018 | 7 | 2018 |
| Anomalous phase transition behavior in hydrothermal grown layered tellurene H Li, K Wu, S Yang, T Boland, B Chen, AK Singh, S Tongay Nanoscale 11 (42), 20245-20251, 2019 | 6 | 2019 |
| Localized Phonon Densities of States at Grain Boundaries in Silicon P Rez, T Boland, C Elsässer, A Singh Microscopy and Microanalysis 28 (3), 672-679, 2022 | 4 | 2022 |
| Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange ML Evans, J Bergsma, A Merkys, CW Andersen, OB Andersson, D Beltrán, ... Digital Discovery 3 (8), 1509-1533, 2024 | 2 | 2024 |
| Reconstructing Lattice Vibrations of Crystals with Electron Ptychography A Gladyshev, B Haas, TM Boland, P Rez, CT Koch arXiv preprint arXiv:2309.12017, 2023 | 1 | 2023 |
| Interpreting Cation Displacements and Image Motifs Associated with the Oxygen Exchange Reaction on CeO2 Nanoparticles T Boland, E Lawrence, BDA Levin, P Rez, PA Crozier Microscopy and Microanalysis 24 (S1), 144-145, 2018 | 1 | 2018 |
| Predicting the Electronic Structure of CeO2 Grain Boundaries for Comparison with Atomic Resolution EELS T Boland, P Crozier, P Rez Microscopy and Microanalysis 23 (S1), 1556-1557, 2017 | 1 | 2017 |
| GPAW: open Python package for electronic-structure calculations J Jørgen Mortensen, A Hjorth Larsen, M Kuisma, AV Ivanov, ... arXiv e-prints, arXiv: 2310.14776, 2023 | | 2023 |
| Atomic Resolution Mapping of Localized Phonon Modes in Silicon Grain Boundaries B Haas, TM Boland, C Elsässer, AK Singh, K March, J Barthel, CT Koch, ... Microscopy and Microanalysis 29 (Supplement_1), 618-619, 2023 | | 2023 |
| Atomic Level Strain Induced by Static and Dynamic Oxygen Vacancies on Reducible Oxide Surfaces P Haluai, TM Boland, EL Lawrence, PA Crozier Available at SSRN 4464681, 2023 | | 2023 |
| High-throughput Identification of Stable 2D Janus-Bulk Material Heterostructures A Singh, T Boland Bulletin of the American Physical Society 67, 2022 | | 2022 |
| High-throughput Identification of Stable 2D Janus-Bulk Materials Heterostructures T Boland, A Singh APS March Meeting Abstracts 2022, G47. 003, 2022 | | 2022 |
| An Atomic Level Study of Localized Strain Fields on Multiple Low-Index Ceria (CeO2) Nanoparticle Surfaces P Haluai, EL Lawrence, T Boland, P Crozier Microscopy and Microanalysis 27 (S1), 2918-2920, 2021 | | 2021 |
| Assessment of Grain Boundary Compositional Effects in Concentrated Ceramic Oxides T Boland, P Rez, P Crozier, A Singh APS March Meeting Abstracts 2021, B61. 001, 2021 | | 2021 |
| Linking Nanoscale Grain Boundary Composition and Energetic Properties in Ceramic Oxides T Boland, A Singh, P Rez, P Crozier Bulletin of the American Physical Society 65, 2020 | | 2020 |
