We study the quantum phase transition of interacting electrons in quantum wires from a one-dimensional (1D) linear configuration to a quasi-1D zigzag arrangement using quantum Monte Carlo methods. As the density increases from its lowest values, first, the electrons form a linear Wigner crystal, then, the symmetry about the axis of the wire is broken as the electrons order in a quasi-1D zigzag phase, and, finally, the electrons form a disordered liquidlike phase. We show that the linear to zigzag phase transition is not destroyed by the strong quantum fluctuations present in narrow wires; it has characteristics which are qualitatively different from the classical transition.
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http://dx.doi.org/10.1103/PhysRevLett.110.246802 | DOI Listing |
J Am Chem Soc
January 2025
Bernal Institute and Department of Chemical Sciences, University of Limerick, Limerick V94 T9PX, Ireland.
2D and 3D porous coordination networks (PCNs) as exemplified by metal-organic frameworks, MOFs, have garnered interest for their potential utility as sorbents for molecular separations and storage. The inherent modularity of PCNs has enabled the development of crystal engineering strategies for systematic fine-tuning of pore size and chemistry in families of related PCNs. The same cannot be said about one-dimensional (1D) coordination polymers, CPs, which are understudied with respect to porosity.
View Article and Find Full Text PDFMolecules
December 2024
International Research Centre Magtop, Institute of Physics, Polish Academy of Sciences, Aleja Lotników 32/46, PL-02668 Warsaw, Poland.
We present first-principles results on the electronic and magnetic properties of the cubic bulk β-phase of Fe2O3. Given that all Fe-Fe magnetic couplings are expected to be antiferromagnetic within this high-symmetry crystal structure, the system may exhibit some signature of magnetic frustration, making it challenging to identify its magnetic ground state. We have analyzed the possible magnetic phases of the β-phase, among which there are ferrimagnets, altermagnets, and Kramers antiferromagnets.
View Article and Find Full Text PDFAdv Mater
December 2024
Department of Chemistry, National University of Singapore, 3 Science Drive 3, Singapore, 117543, Singapore.
Materials with flat bands can serve as a promising platform to investigate strongly interacting phenomena. However, experimental realization of ideal flat bands is mostly limited to artificial lattices or moiré systems. Here, a general way is reported to construct 1D flat bands in phosphorene nanoribbons (PNRs) with a pentagonal nature: penta-hexa-PNRs and penta-dodeca-PNRs, wherein the corresponding 1D flat bands are directly verified by using angle-resolved photoemission spectroscopy.
View Article and Find Full Text PDFJ Am Chem Soc
December 2024
School of Physical Science and Technology, Shanghai Key Laboratory of High-Resolution Electron Microscopy, State Key Laboratory of Advanced Medical Materials and Devices, ShanghaiTech University, Shanghai 201210, China.
ACS Nano
December 2024
Innovation Center for Textile Science and Technology, College of Textiles, Donghua University, Shanghai 201620, China.
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