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Showing 1–13 of 13 results for author: Devi, S

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  1. arXiv:2605.06545  [pdf, ps, other

    cond-mat.str-el cond-mat.supr-con

    Emergence of a correlated insulating state in bulk 1T-NbSe$_2$ via metal intercalation

    Authors: M. Tomlinson, AKM A. Rahman, S. Devi, R. Tuchikawa, M. Ishigami, D. Le, Md Z. Mohayman, A. Kushima, Y. Nakajima

    Abstract: The 1T polymorph of NbSe$_2$, long confined to the monolayer limit, has remained inaccessible in bulk. Here, we report the realization of bulk 1T-NbSe$_2$ via electrochemical Sn intercalation. Transmission electron microscopy directly reveals the formation of the 1T structure induced by Sn intercalation. The intercalated samples exhibit insulating transport behavior, in stark contrast to metallic… ▽ More

    Submitted 7 May, 2026; originally announced May 2026.

    Comments: 6 pages, 5 figures

  2. arXiv:2602.14650  [pdf, ps, other

    cond-mat.mtrl-sci physics.comp-ph

    Data-Efficient Machine learning for Predicting Dopant Formation Energies in TiO$_2$ Monolayer

    Authors: Kati Asikainen, Matti Alatalo, Marko Huttula, Assa Aravindh Sasikala Devi

    Abstract: Machine learning models are increasingly applied in materials science, yet their predictive power is often constrained by data scarcity. Here, we show that accurate predictions can be achieved, even with a limited number of training examples, provided the dataset is compact and and grounded in physically relevant quantities. By combining density functional theory calculations with a machine-learni… ▽ More

    Submitted 16 February, 2026; originally announced February 2026.

  3. arXiv:2602.12378  [pdf, ps, other

    cond-mat.mtrl-sci

    Investigating the Electronic and Magnetic Properties of Na$_x$Fe$_{1/2}$Mn$_{1/2}$O$_2$ Cathode Materials with X-ray Compton Scattering

    Authors: Veenavee Nipunika Kothalawala, Kosuke Suzuki, Johannes Nokelainen, Ilja Makkonen, Erica West, Lassi Roininen, Jere Leinonen, Pekka Tynjälä, Petteri Laine, Juho Välikangas, Ulla Lassi, Assa Aravindh Sasikala Devi, Matti Alatalo, Yuki Mizuno, Naruki Tsuji, Hikaru Usami, Yuju Nagasaki, Tsuyoshi Takami, Yoshiharu Sakurai, Hiroshi Sakurai, Mohammad Babar, Venkat Vishwanathan, Arun Bansil, Bernardo Barbiellini

    Abstract: We discuss electronic and magnetic properties of Na$_x$Fe$_{1/2}$Mn$_{1/2}$O$_2$, a promising Na-ion battery cathode material. Using x-ray Compton scattering, SQUID magnetometry, and density-functional-theory based modeling, we probe how electrons and spins evolve during sodiation. By comparing Compton profiles of sodiated and desodiated samples, we show that oxygen 2$p$ orbitals drive the redox p… ▽ More

    Submitted 12 February, 2026; originally announced February 2026.

    Comments: 12 pages, 8 figures

  4. arXiv:2601.09046  [pdf, ps, other

    cond-mat.str-el

    Coexistence of long-range magnetic order and dynamical magnetism in the V-based Kagome metals: A combined thermodynamic and $μ$SR study

    Authors: Sheetal Devi, Yishui Zhou, Thomas J. Hicken, Zurab Guguchia, Hubertus Luetkens, Min-Kai Lee, Lieh-Jeng Chang, Yixi Su

    Abstract: V-based Kagome metals exhibit a unique lattice geometry that can give rise to exotic electronic and magnetic phenomena, making them an ideal platform to study the interplay of topology and magnetism. We present a combined thermodynamic and muon spin relaxation ($μ$SR) investigation of single-crystal RV$_{6}$Sn$_{6}$ (R = Tb, Dy, Ho, Er) compounds, focusing on their low-temperature magnetic behavio… ▽ More

    Submitted 13 January, 2026; originally announced January 2026.

    Comments: 8 pages, 4 figures

  5. arXiv:2411.14415  [pdf, other

    cond-mat.str-el cond-mat.mtrl-sci

    Ground-state magnetic structures of topological kagome metals RV$_6$Sn$_6$ (R = Tb, Dy, Ho, Er)

    Authors: Yishui Zhou, Min-Kai Lee, Sabreen Hammouda, Sheetal Devi, Shin-Ichiro Yano, Romain Sibille, Oksana Zaharko, Wolfgang Schmidt, Karin Schmalzl, Ketty Beauvois, Eric Ressouche, Po-Chun Chang, Chun-Hao Huang, Lieh-Jeng Chang, Thomas Brückel, Yixi Su

    Abstract: Magnetic kagome metals have attracted tremendous research interests recently, because they represent an ideal playground for exploring the fascinating interplay between their intrinsically inherited topologically non-trivial electron band structures, magnetism and electronic correlation effects, and the resultant novel electronic/magnetic states and emergent excitations. In this work, we report a… ▽ More

    Submitted 21 November, 2024; originally announced November 2024.

    Comments: To appear in Phys. Rev. Research

    Journal ref: Phys. Rev. Research 6, 043291 (2024)

  6. Compton scattering study of strong orbital delocalization in a LiNiO$_2$ cathode

    Authors: Veenavee Nipunika Kothalawala, Kosuke Suzuki, Johannes Nokelainen, Arttu Hyvönen, Ilja Makkonen, Bernardo Barbiellini, Hasnain Hafiz, Pekka Tynjälä, Petteri Laine, Juho Välikangas, Tao Hu, Ulla Lassi, Kodai Takano, Naruki Tsuji, Yosuke Amada, Assa Aravindh Sasikala Devi, Matti Alatalo, Yoshiharu Sakurai, Hiroshi Sakurai, Arun Bansil

    Abstract: Cobalt is used in Li-ion batteries, but it is expensive and could be replaced by nickel to deliver better performance at a lower cost. With this motivation, we discuss how the character of redox orbitals of LiNiO$_2$ can be ascertained through x-ray Compton scattering measurements combined with parallel first-principles simulations. Our analysis reveals the nature of hole states in Li-doped NiO re… ▽ More

    Submitted 22 January, 2024; originally announced January 2024.

    Comments: 5 pages, 5 figures

    Journal ref: volume = 109, year =2024

  7. arXiv:2306.17554  [pdf, other

    physics.optics cond-mat.mtrl-sci

    Ab initio insights on the ultrafast strong-field dynamics of anatase TiO$_2$

    Authors: Sruthil Lal S. B, Lokamani, Kushal Ramakrishna, Attila Cangi, D Murali, Matthias Posselt, Assa Aravindh Sasikala Devi, Alok Sharan

    Abstract: Electron dynamics of anatase TiO$_2$ under the influence of ultrashort and intense laser field is studied using the real-time time-dependent density functional theory (TDDFT). Our findings demonstrate the effectiveness of TDDFT calculations in modeling the electron dynamics of solids during ultrashort laser excitation, providing valuable insights for designing and optimizing nonlinear photonic dev… ▽ More

    Submitted 30 June, 2023; originally announced June 2023.

    Comments: 27 Pages (Including 3 pages of supplemental material), 7 figures

  8. arXiv:2112.03027  [pdf, other

    cond-mat.mtrl-sci physics.optics

    Quasiparticle electronic structure and optical response ($G_0W_0$+BSE) of anatase TiO$_2$ starting from modified HSE06 functionals

    Authors: Sruthil Lal S. B, D Murali, Matthias Posselt, Assa Aravindh Sasikala Devi, Alok Sharan

    Abstract: The quasiparticle electronic structure and optical excitation of anatase TiO$_2$ is determined within the framework of many-body perturbation theory (MBPT) by combining the $G_0W_0$ method and the Bethe-Salpeter Equation (BSE). A modified version of the HSE06 screened hybrid functional, that includes 20\% exact Fock exchange (HSE06(20)) as opposed to 25\% in the standard HSE06 functional, is used… ▽ More

    Submitted 1 December, 2021; originally announced December 2021.

  9. arXiv:1608.07752  [pdf

    q-fin.ST cond-mat.stat-mech

    Financial Market Dynamics: Superdiffusive or not?

    Authors: Sandhya Devi

    Abstract: The behavior of stock market returns over a period of 1-60 days has been investigated for S&P 500 and Nasdaq within the framework of nonextensive Tsallis statistics. Even for such long terms, the distributions of the returns are non-Gaussian. They have fat tails indicating that the stock returns do not follow a random walk model. In this work, a good fit to a Tsallis q-Gaussian distribution is obt… ▽ More

    Submitted 14 September, 2017; v1 submitted 27 August, 2016; originally announced August 2016.

    Comments: The paper has gone through considerable revisions after referees' comments. The major changes are, The old introduction has been split into Section 1: Introduction and Section 2: A brief review of the Theory. The Results section now has 4 subsections. Section 5 (Conclusions) is reworded but the conclusions remain the same. Some additional references have been added. 29 pages. 11 Figures

    Journal ref: J. Stat. Mech. (2017) 083207

  10. arXiv:1006.0417  [pdf

    cond-mat.mtrl-sci

    Electric and magnetic polarizabilities of hexagonal Ln2CuTiO6 (Ln=Y, Dy, Ho, Er and Yb)

    Authors: Debraj Choudhury, Abhijit Hazarika, Adyam Venimadhav, Chandrasekhar Kakarla, Kris T. Delaney, P. Sujatha Devi, P. Mondal, R. Nirmala, J. Gopalakrishnan, Nicola A. Spaldin, Umesh V. Waghmare, D. D. Sarma

    Abstract: We investigated the rare-earth transition metal oxide series, Ln2CuTiO6 (Ln=Y, Dy, Ho, Er and Yb), crystallizing in the hexagonal structure with non-centrosymmetric P63cm space group for possible occurrences of multiferroic properties. Our results show that while these compounds, except Ln=Y, exhibit a low temperature antiferromagnetic transition due to the ordering of the rare-earth moments, the… ▽ More

    Submitted 24 September, 2010; v1 submitted 2 June, 2010; originally announced June 2010.

    Comments: Accepted for publication in Phys. Rev. B (21 pages, 2 Table, 8 Figures)

  11. arXiv:0808.3043  [pdf

    cond-mat.str-el

    Correlation between extrinsic electroresistance and magnetoresistance in fine-grained La0.7Ca0.3MnO3

    Authors: P. Sujatha Devi, A. Kumar, Dipten Bhattacharya, Shilpi Karmakar, B. K. Chaudhuri

    Abstract: We report our observation of a correlation between the extrinsic electroresistance (EER) and magnetoresistance (EMR) via grain size in fine-grained La0.7Ca0.3MnO3. The nature of dependence of EER and EMR on grain size (~0.2-1.0 micron) indicates that for finer grains with low-resistive boundaries both of them follow similar trend whereas they differ for coarser grains with high-resistive boundarie… ▽ More

    Submitted 27 August, 2010; v1 submitted 22 August, 2008; originally announced August 2008.

    Comments: 19 pages including 4 figures; pdf only

    Journal ref: Jpn. J. Appl. Phys. 49, 083001 (2010)

  12. arXiv:0705.2498  [pdf

    cond-mat.mtrl-sci

    Ferromagnetism in nanoscale BiFeO3

    Authors: R. Mazumder, P. Sujatha Devi, Dipten Bhattacharya, P. Choudhury, A. Sen, M. Raja

    Abstract: A remarkably high saturation magnetization of ~0.4mu_B/Fe along with room temperature ferromagnetic hysteresis loop has been observed in nanoscale (4-40 nm) multiferroic BiFeO_3 which in bulk form exhibits weak magnetization (~0.02mu_B/Fe) and an antiferromagnetic order. The magnetic hysteresis loops, however, exhibit exchange bias as well as vertical asymmetry which could be because of spin pin… ▽ More

    Submitted 17 May, 2007; originally announced May 2007.

    Comments: 13 pages including 4 figures; pdf only; submitted to Appl. Phys. Lett

    Journal ref: Appl. Phys. Lett. 91, 062510 (2007)

  13. arXiv:cond-mat/0412170  [pdf

    cond-mat.str-el cond-mat.mtrl-sci

    Orbital order-disorder transition in La(1-x)Nd(x)MnO(3) (x = 0.0-1.0) and La(1-x-y)Nd(yx)Sr(y)MnO(3) (x = 0.1; y = 0.05,0.1)

    Authors: Dipten Bhattacharya, P. Sujatha Devi, H. S. Maiti

    Abstract: The nature of orbital order-disorder transition has been studied in the La(1-x)Nd(x)MnO(3) (x = 0.0-1.0) series which covers the entire range between two end points - LaMnO(3) and NdMnO(3) - as well as in La(0.85)Nd(0.1)Sr(0.05)MnO(3) and La(0.8)Nd(0.1)Sr(0.1)MnO(3). It has been observed that the first-order nature of the transition gives way to higher order with the increase in "x" in the case… ▽ More

    Submitted 7 December, 2004; originally announced December 2004.

    Comments: 15 pages including 4 figures; pdf only

    Journal ref: Phys. Rev. B 70, 184415 (2004)