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Transition metal dichalcogenides offer unprecedented versatility to engineer 2D materials with tailored properties to explore novel structural and electronic phase transitions. In this work, we present the atomic-scale evolution of the…

Materials Science · Physics 2022-03-16 Wen Wan , Darshana Wickramaratne , Paul Dreher , Rishav Harsh , I. I. Mazin , Miguel M. Ugeda

One of the basic assumptions in organic field-effect transistors, the most fundamental device unit in organic electronics, is that charge transport occurs two-dimensionally in the first few molecular layers near the dielectric interface.…

Mesoscale and Nanoscale Physics · Physics 2016-01-11 Yuhan Zhang , Jingsi Qiao , Si Gao , Fengrui Hu , Daowei He , Bing Wu , Ziyi Yang , Bingchen Xu , Yun Li , Yi Shi , Wei Ji , Peng Wang , Xiaoyong Wang , Min Xiao , Hangxun Xu , Jian-Bin Xu , Xinran Wang

2H-NbSe2 is known to be an archetype layered transitional metal dichalcogenide superconductor with a superconducting transition temperature of 7.3 K.In this article, we investigate the influence of Sn intercalation on superconducting…

We report first principles calculations, within density functional theory, of copper intercalated titanium diselenides, CuxTiSe2, for values of x ranging from 0 to 0.11. The effect of intercalation on the energy bands and densities of…

Superconductivity · Physics 2009-01-12 R. A. Jishi , H. M. Alyahyaei

Plasmons in low dimensional materials provide a powerful platform for nanoscale control of light matter interactions, yet strategies to tailor their coherence and dissipation remain limited. Here, we demonstrate that transition metal…

Transition metal dichalcogenides (TMDs) exist in various crystal structures with semiconducting, semi-metallic, and metallic properties. The dynamic control of these phases is of immediate interest for next generation electronics such as…

Materials Science · Physics 2026-01-21 Dante Zakhidov , Daniel A. Rehn , Evan J. Reed , Alberto Salleo

The interface between a metal electrode and an organic semiconductor (OS) layer has a defining role in the properties of the resulting device. To obtain a desired performance, interlayers are introduced to modify the adhesion and growth of…

The layered transition metal dichalcogenide, TaSe2, exhibits rich electronic phenomena across its polymorphs, 1T, 2H, and 3R, largely driven by differences in atomic coordination and c-axis stacking. In the 1T phase, octahedral coordination…

Superconductivity · Physics 2026-02-13 Kusal Dharmasiri , Maxim Avdeev , Despina Louca

At ambient pressure, bulk 2H-NbS$_2$ displays no charge density wave instability at odds with the isostructural and isoelectronic compounds 2H-NbSe$_2$, 2H-TaS$_2$ and 2H-TaSe$_2$, and in disagreement with harmonic calculations.…

Materials Science · Physics 2019-04-25 Raffaello Bianco , Ion Errea , Lorenzo Monacelli , Matteo Calandra , Francesco Mauri

We study the magnetic and electronic properties of Ni-intercalated NbSe$_2$.We calculate the magnetic exchanges of Ni$_x$NbSe$_2$ ($x = 1/3, 1/4,$ and $1$) and find that the out-of-plane magnetic coupling depends on the Ni connectivity: it…

Materials Science · Physics 2025-11-20 Xujia Gong , Amar Fakhredine , Carmine Autieri

The intercalation of alkali ions into layered materials has played an essential role in battery technology since the development of the first lithium-ion electrodes. Coulomb repulsion between the intercalants leads to ordering of the…

Recent experiments show that charge-density-wave correlations are prevalent in underdoped cuprate superconductors. The correlations are short ranged at weak magnetic fields but their intensity and spatial extent increase rapidly at low…

Superconductivity · Physics 2016-01-20 Yosef Caplan , Gideon Wachtel , Dror Orgad

Bulk TiSe$_2$ is an intrinsically layered transition metal dichalcogenide (TMD) hosting both superconducting and charge density wave (CDW) ordering. Motivated by the recent progress in preparing two-dimensional TMDs, we study these…

Superconductivity · Physics 2015-02-04 R. Ganesh , G. Baskaran , Jeroen van den Brink , Dmitry V. Efremov

Disorder is generically anticipated to suppress long range charge density wave (CDW) order. We report transport, thermodynamic, and scattering experiments on Pd$_x$ErTe$_3$, a model CDW system with disorder induced by intercalation. The…

Strongly Correlated Electrons · Physics 2019-06-24 J. A. W. Straquadine , F. Weber , S. Rosenkranz , A. H. Said , I. R. Fisher

We report on high-pressure (p_max = 2.1 GPa) muon spin rotation experiments probing the temperature-dependent magnetic penetration depth in the layered superconductor 2H-NbSe_2. Upon increasing the pressure, we observe a substantial…

Atomically thin NbSe2 is a metallic layered transition metal dichalcogenide (TMD) with considerably different crystallographic structure and electronic properties from other TMDs, such as MoS2, MoSe2, WS2 and WSe2. Properties of TMD atomic…

Mesoscale and Nanoscale Physics · Physics 2016-09-05 Rui He , Jeremiah van Baren , Jia-An Yan , Xiaoxiang Xi , Zhipeng Ye , Gaihua Ye , I-Hsi Lu , S. M. Leong , C. H. Lui

In this study, we employ first-principles density functional theory (DFT) calculations to investigate the electrochemical properties of Nb2C and Nb2CO2 MXenes as potential anode materials for sodium-ion (SIBs) and lithium-ion batteries…

Materials Science · Physics 2025-04-15 Nishat Sultana , Abdullah A. Amin , Eric J. Payton , Woo Kyun Kim

Modulating electronic structure of monolayer transition metal dichalcogenides (TMDCs) is important for many applications and doping is an effective way towards this goal, yet is challenging to control. Here we report the in-situ…

Recent STM experiments reveal niobium diselenide to support domains of striped (1Q) charge order side-by-side with its better-known triangular (3Q) phase, suggesting that small variations in local strain may induce a quantum phase…

Strongly Correlated Electrons · Physics 2015-11-18 Felix Flicker , Jasper van Wezel

Charge density wave (CDW) ordering in NbSe3 and the structurally related quasi one-dimensional compounds is reconsidered. Since the modulated ground state is characterized by unstable nano-domains, the structural information obtained from…

Mesoscale and Nanoscale Physics · Physics 2013-03-27 Albert Prodan , Herman J. P. van Midden , Erik Zupanič , Rok Žitko