Search Results - "Grosso, Bastien F"

Combined Electrostatic and Strain Engineering of BiFeO3 Thin Films at the Morphotropic Phase Boundary by Nordlander, Johanna, Grosso, Bastien F., Rossell, Marta D., Maillard, Aline, Yan, Bixin, Gradauskaite, Elzbieta, Spaldin, Nicola A., Fiebig, Manfred, Trassin, Morgan

“…Multiferroic BiFeO3 exhibits a morphotropic phase boundary at large compressive strain that merges metastable phases of tetragonal (T) and rhombohedral (R)…”
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Physics-Guided Descriptors for Prediction of Structural Polymorphs by Grosso, Bastien F., Spaldin, Nicola A., Tehrani, Aria Mansouri

“…We develop a method combining machine learning (ML) and density functional theory (DFT) to predict low-energy polymorphs by introducing physics-guided…”
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Bending Rules in Graphene Kirigami by Grosso, Bastien F, Mele, E J

“…The three-dimensional shapes of graphene sheets produced by nanoscale cut-and-join kirigami are studied by combining large-scale atomistic simulations with…”
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Accessible chemical space for metal nitride perovskites by Grosso, Bastien F, Davies, Daniel W, Zhu, Bonan, Walsh, Aron, Scanlon, David O

“…Building on the extensive exploration of metal oxide and metal halide perovskites, metal nitride perovskites represent a largely unexplored class of materials…”
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Non-volatile electric-field control of inversion symmetry by Caretta, Lucas, Shao, Yu-Tsun, Yu, Jia, Mei, Antonio B., Grosso, Bastien F., Dai, Cheng, Behera, Piush, Lee, Daehun, McCarter, Margaret, Parsonnet, Eric, K. P, Harikrishnan, Xue, Fei, Guo, Xiangwei, Barnard, Edward S., Ganschow, Steffen, Hong, Zijian, Raja, Archana, Martin, Lane W., Chen, Long-Qing, Fiebig, Manfred, Lai, Keji, Spaldin, Nicola A., Muller, David A., Schlom, Darrell G., Ramesh, Ramamoorthy

“…Competition between ground states at phase boundaries can lead to significant changes in properties under stimuli, particularly when these ground states have…”
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Accelerated search for new ferroelectric materials by Frey, Ramon, Grosso, Bastien F., Fandré, Pascal, Mächler, Benjamin, Spaldin, Nicola A., Mansouri Tehrani, Aria

“…We report the development of a combined machine learning and high-throughput density functional theory (DFT) framework to accelerate the search for new…”
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Liberating a hidden antiferroelectric phase with interfacial electrostatic engineering by Mundy, Julia A, Grosso, Bastien F, Heikes, Colin A, Ferenc Segedin, Dan, Wang, Zhe, Shao, Yu-Tsun, Dai, Cheng, Goodge, Berit H, Meier, Quintin N, Nelson, Christopher T, Prasad, Bhagwati, Xue, Fei, Ganschow, Steffen, Muller, David A, Kourkoutis, Lena F, Chen, Long-Qing, Ratcliff, William D, Spaldin, Nicola A, Ramesh, Ramamoorthy, Schlom, Darrell G

“…Antiferroelectric materials have seen a resurgence of interest because of proposed applications in a number of energy-efficient technologies. Unfortunately,…”
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Transport Properties of Doped Wide Band Gap Layered Oxychalcogenide Semiconductors Sr 2 GaO 3 Cu Ch , Sr 2 ScO 3 Cu Ch , and Sr 2 InO 3 Cu Ch ( Ch = S or Se) by Malik, Zahida, Kemp, Liam, Grosso, Bastien F., Davies, Daniel W., Scanlon, David O., Hyett, Geoffrey

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Predicting ground-state and metastable crystal structures using elemental and phonon mode descriptors by Tehrani, Aria Mansouri, Grosso, Bastien F., Frey, Ramon, Spaldin, Nicola A.

“…Abstract only…”
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Combined Electrostatic and Strain Engineering of BiFeO 3 Thin Films at the Morphotropic Phase Boundary by Nordlander, Johanna, Grosso, Bastien F., Rossell, Marta D., Maillard, Aline, Yan, Bixin, Gradauskaite, Elzbieta, Spaldin, Nicola A., Fiebig, Manfred, Trassin, Morgan

“…Abstract Multiferroic BiFeO 3 exhibits a morphotropic phase boundary at large compressive strain that merges metastable phases of tetragonal (T) and…”
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Prediction of new low-energy phases of BiFeO$_3$ with large unit cell and complex tilts beyond Glazer notation by Grosso, Bastien F, Spaldin, Nicola A

“…Phys. Rev. Materials 5, 054403 (2021) Bismuth ferrite is one of the most widely studied multiferroic materials because of its large ferroelectric polarisation…”
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Accessible Chemical Space for Metal Nitride Perovskites by Grosso, Bastien F, Davies, Daniel W, Zhu, Bonan, Walsh, Aron, Scanlon, David O

“…Building on the extensive exploration of metal oxide and metal halide perovskites, metal nitride perovskites represent a largely unexplored class of materials…”
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Physics-guided descriptors for prediction of structural polymorphs by Grosso, Bastien F, Spaldin, Nicola A, Tehrani, Aria Mansouri

“…J. Phys. Chem. Lett. 2022, 13, 31, 7342 We develop a method combining machine learning (ML) and density functional theory (DFT) to predict low-energy…”
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Accelerated search for new ferroelectric materials by Frey, Ramon, Grosso, Bastien F, Fandré, Pascal, Mächler, Benjamin, Spaldin, Nicola A, Tehrani, Aria Mansouri

“…We report the development of a combined machine-learning and high-throughput density functional theory (DFT) framework to accelerate the search for new…”
Get full text

Combined electrostatic and strain engineering of BiFeO$_3$ thin films at the morphotropic phase boundary by Nordlander, Johanna, Grosso, Bastien F, Rossell, Marta D, Maillard, Aline, Gradauskaite, Elzbieta, Spaldin, Nicola A, Fiebig, Manfred, Trassin, Morgan

“…Multiferroic BiFeO$_3$ (BFO) possesses a rich phase diagram that allows strain tuning of its properties in thin-film form. In particular, at large compressive…”
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Bending Rules for Nano-Kirigami by Grosso, Bastien F, Mele, E. J

“…Physical Review Letters 115, 195501 (2015) We combine large-scale atomistic modelling with continuum elastic theory to study the shapes of graphene sheets…”
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Nonvolatile Electric-Field Control of Inversion Symmetry by Caretta, Lucas, Shao, Yu-Tsun, Yu, Jia, Mei, Antonio B, Grosso, Bastien F, Dai, Cheng, Behera, Piush, Lee, Daehun, McCarter, Margaret, Parsonnet, Eric, P, Harikrishnan K, Xue, Fei, Barnard, Ed, Ganschow, Steffen, Raja, Archana, Martin, Lane W, Chen, Long-Qing, Fiebig, Manfred, Lai, Keji, Spaldin, Nicola A, Muller, David A, Schlom, Darrell G, Ramesh, Ramamoorthy

“…In condensed-matter systems, competition between ground states at phase boundaries can lead to significant changes in material properties under external…”
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A high-energy density antiferroelectric made by interfacial electrostatic engineering by Mundy, Julia A, Heikes, Colin A, Grosso, Bastien F, Segedin, Dan Ferenc, Wang, Zhe, Goodge, Berit H, Meier, Quintin N, Nelson, Christopher T, Prasad, Bhagwati, Kourkoutis, Lena F, Ratcliff, William D, Spaldin, Nicola A, Ramesh, Ramamoorthy, Schlom, Darrell G

“…Dielectric capacitors hold a tremendous advantage for energy storage due to their fast charge/discharge times and stability in comparison to batteries and…”
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