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Angela F. Harper
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Controlling nucleation, growth, and orientation of metal halide perovskite thin films with rationally selected additives
BJ Foley, J Girard, BA Sorenson, AZ Chen, JS Niezgoda, MR Alpert, ...
Journal of materials chemistry A 5 (1), 113-123, 2017
1362017
An atlas of peroxiredoxins created using an active site profile-based approach to functionally relevant clustering of proteins
AF Harper, JB Leuthaeuser, PC Babbitt, JH Morris, TE Ferrin, LB Poole, ...
PLoS Computational Biology 13 (2), e1005284, 2017
262017
Computational investigation of copper phosphides as conversion anodes for lithium-ion batteries
AF Harper, ML Evans, AJ Morris
Chemistry of Materials 32 (15), 6629-6639, 2020
242020
Laser‐Printed Organic Thin‐Film Transistors
PJ Diemer, AF Harper, MR Niazi, AJ Petty, JE Anthony, A Amassian, ...
Advanced Materials Technologies 2 (11), 1700167, 2017
242017
Contact patterning by laser printing for flexible electronics on paper
AF Harper, PJ Diemer, OD Jurchescu
npj Flexible Electronics 3 (1), 11, 2019
192019
Ab initio Structure Prediction Methods for Battery Materials
AF Harper, ML Evans, JP Darby, B Karasulu, CP Košer, JR Nelson, ...
Johnson Matthey Technology Review, 2019
18*2019
An approach to functionally relevant clustering of the protein universe: Active site profile‐based clustering of protein structures and sequences
ST Knutson, BM Westwood, JB Leuthaeuser, BE Turner, D Nguyendac, ...
Protein Science 26 (4), 677-699, 2017
152017
Modelling amorphous materials via a joint solid-state NMR and X-ray absorption spectroscopy and DFT approach: application to alumina
AF Harper, SP Emge, PCMM Magusin, CP Grey, AJ Morris
Chemical Science 14 (5), 1155-1167, 2023
92023
DASP3: identification of protein sequences belonging to functionally relevant groups
JB Leuthaeuser, JH Morris, AF Harper, TE Ferrin, PC Babbitt, JS Fetrow
BMC bioinformatics 17, 1-13, 2016
82016
Ab Initio Prediction of Metal Phosphide Anode Materials for Lithium and Beyond Lithium Batteries
AF Harper
12019
Tracking Li atoms in real-time with ultra-fast NMR simulations
AF Harper, T Huss, SS K÷cher, C Scheurer
2024
Vibrational and thermal properties of amorphous alumina from first principles
AF Harper, K Iwanowski, WC Witt, MC Payne, M Simoncelli
Physical Review Materials 8 (4), 043601, 2024
2024
Structure prediction of stable sodium germanides at 0 and 10 GPa
JP Darby, AF Harper, JR Nelson, AJ Morris
arXiv preprint arXiv:2402.15299, 2024
2024
Research data supporting" Finite-Temperature Effects on the X-ray Absorption Spectra of Crystalline Aluminas from First Principles"
A Harper
2023
Finite-temperature effects on the x-ray absorption spectra of crystalline alumina from first principles
AF Harper, B Monserrat, AJ Morris
AIP Advances 13 (5), 2023
2023
Research data supporting" Modelling amorphous materials via a joint solid-state NMR and X-ray absorption spectroscopy and DFT approach: application to alumina"
A Harper, SP Emge, P Magusin, CP Grey, AJ Morris
2023
Extending first principles spectroscopy to disordered materials: a study on amorphous and crystalline aluminas
AF Harper
2022
First Principles Model of Amorphous ALD Deposited Al2O3
A Harper, A Morris, S Emege, C Grey
APS March Meeting Abstracts 2021, X20. 007, 2021
2021
Research data supporting" Computational Investigation of Copper Phosphides as Conversion Anodes for Lithium-Ion Batteries"
A Harper, M Evans, A Morris
2020
Laser‐Printed Organic Thin‐Film Transistors
PJ Diemer, AF Harper, MR Niazi, AJ Petty, JE Anthony, A Amassian, ...
Advanced Materials Technologies 4 (2), 1800651, 2019
2019
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