Publications

Home » Publications

Recent Publications by CCP9 CoSeC staff:

  • “Kagomerization of transition metal monolayers induced by two-dimensional hexagonal boron nitride”, Nat. Commun. 15, 4854 (2024), Hangyu Zhou, Manuel dos Santos Dias, Youguang Zhang, Weisheng Zhao & Samir Lounis.
  • “Electrical engineering of topological magnetism in two-dimensional heterobilayers”, npj Spintronic 2, 10 (2024), Nihad Abuawwad, Manuel dos Santos Dias, Hazem Abusara, Samir Lounis.
  • “Ultrafast light-induced magnetization in non-magnetic films: from orbital and spin Hall phenomena to the inverse Faraday effect”, Front. Phys. 12, 1354870 (2024), Hanan Hamamera, Manuel dos Santos Dias, Filipe Souza Mendes Guimarães, Samir Lounis.
  • “Electronic structure and magnetism in 𝑃⁢4/𝑛⁢𝑚⁢𝑚 KCoO2”, Phys. Rev. B 109, 184442 (2024), Ozan Dernek, Santosh Kumar Radha, Jerome Jackson, and Walter R. L. Lambrecht.
  • “An overview of the spin dynamics of antiferromagnetic Mn5Si3“, APL Materials 11, 081103 (2023), Santos, F. J.; M. dos Santos Dias, Raymond, S.; Schmalzl, K.; Steffens, P.; Persson, J.; Marzari, N.; Blügel, S.; Lounis, S. & Brückel, T.
  • “CrTe2 as a two-dimensional material for topological magnetism in complex heterobilayers“, Phys Rev B 108, 094409 (2023), N. Abuawwad, M. dos Santos Dias, H. Abusara, and S. Lounis.
  • “Microscopic theory of spin relaxation of a single Fe adatom coupled to substrate vibrations”, Phys. Rev. B 107, 144417 (2023) H. Garai-Marin, M. dos Santos Dias, S. Lounis, J. Ibañez-Azpiroz, and A. Eiguren.
  • “CRYSTAL23: A program for computational solid state physics and chemistry”, J. Chem. Theory Comput. (2022), A. Erba, J. K. Desmarais, S. Casassa, B. Civalleri, L. Donà, I. J. Bush, B. Searle, L. Maschio, L. Edith-Daga, A. Cossard, C. Ribaldone, E. Ascrizzi, N. L. Marana, J-P. Flament, and B. Kirtman
  • “Incommensurate ordering in CrB2”, J. Phys.: Condens. Matter, 34, 475801 (2022), A. Deak, J. Jackson, B. Nyari, and L. Szunyogh
  • “Noncollinear magnetism in two-dimensional CrTe2“, J. Phys.: Condens. Matter, 34, 454001 (2022) , N. Abuawwad, M. dos Santos Dias, H. Abusara, and S, Lounis 
  • “Temperature-dependent micromagnetic model of the antiferromagnet Mn2Au: A multiscale approach”, Phys. Rev. B 106, 094402 (2022), J. Hirst, U. Atxitia, S. Ruta, J. Jackson, L. Petit, and T. Ostler
  • “Analytic expressions for Hubbard models with arbitrary structures in programmable optical lattices”, Phys. Rev. A 104, 053321 (2021) , J. P. Hague, L. Petit, and C. MacCormick
  • “Electronic structure and finite temperature magnetism of yttrium iron garnet”, Electron. Struct., 2, 044002 (2020), J. Barker, D. Pashov, and J. Jackson
  • “Experimental and theoretical study of the correlated compound YbCdSn: Evidence for large magnetoresistance and mass enhancement”, Phys. Rev. B, 102, 235135 (2020), Antu Laha, P. Rambabu, V. Kanchana, L. Petit, Z. Szotek, and Z. Hossain
  • “Questaal: Electronic structure for the future”, Psi-k Highlight of the Month #148 (2020), D. Pashov, S. Acharya, J. Jackson, B. Cunningham, M. Grüning, M. van Schilfgaarde
  • “First-order ferromagnetic transitions of lanthanide local moments in divalent compounds: An itinerant electron positive feedback mechanism and Fermi surface topological change”, Physical Review B 101, 174437 (2020), E. Mendive-Tapia, D. Paudyal , L. Petit, and J. B. Staunton
  • “Spin waves in metallic iron and nickel measured by soft x-ray resonant inelastic scattering”, Physical Review B, 102, 064412 (2020), N. B. Brookes, D. Betto, K. Cao, Y. Lu, K. Kummer, and F. Giustino.
  • “Magnetic structure of selected Gd intermetallic alloys from first principles”, Phys. Rev. B 101, 014409, 2020, L. Petit, Z. Szotek, D. Paudyal, A. Biswas, Y. Mudryk, V. K. Pecharsky, and J. B. Staunton.
  • “Questaal: A package of electronic structure methods based on the linear muffin-tin orbital technique”, Comput. Phys. Comm. 249, 107065, (2020), D.Pashov, S. Acharya, W. R.L. Lambrecht, J. Jackson, K. D. Belashchenko, A. Chantis, F. Jamet and M. van Schilfgaarde
  • “Magnetic excitations in non-collinear antiferromagnetic Weyl semimetal Mn3Sn”, npj Quant. Mater. 3, 63 (2018), P. Park, J. Oh, K. Uhlířová, J. Jackson, A. Deák, L. Szunyogh, K. H. Lee, H. Cho, H. L. Kim, H. C. Walker, D. Adroja, V. Sechovský & J. -G Park
  • “Calculating the Magnetic Anisotropy of Rare-Earth–Transition-Metal Ferrimagnets”, Phys. Rev. Lett. 120, 097202 (2018), C. E. Patrick, S. Kumar, G. Balakrishnan, R. S. Edwards, M. R. Lees, L. Petit, and J. B. Staunton.
  • “Rare-earth/transition-metal magnetic interactions in pristine and (Ni,Fe)-doped YCo5 and GdCo5”, Phys. Rev. Mat. 1, 02411 (2017), C. E. Patrick,  S. Kumar,  G. Balakrishnan, R. S. Edwards, M. R. Lees, E. Mendive-Tapia, L. Petit, and J. B. Staunton.