Works matching DE "SPIN-density functional theory"

Results: 36

Skyrmions in a density wave state: A mechanism for chiral superconductivity.

Published in:

Modern Physics Letters B, 2015, v. 29, n. 16, p. 1, doi. 10.1142/S0217984915400539

By:

Chakravarty, Sudip;
Hsu, Chen-Hsuan

Publication type:

Article

Thermodynamic Properties of Superconductor with Competing Spin-Density Wave and Charge-Density Wave.

Published in:

Journal of Superconductivity & Novel Magnetism, 2015, v. 28, n. 8, p. 2299, doi. 10.1007/s10948-015-3049-y

By:

Thongcham, K.;
Udomsamuthirun, P.

Publication type:

Article

First-Principle Calculations of Structural, Electronic, and Magnetic Properties of Cubic Al TMN (TM = V, Cr, Mn, Fe).

Published in:

Journal of Superconductivity & Novel Magnetism, 2014, v. 27, n. 12, p. 2647, doi. 10.1007/s10948-014-2616-y

By:

Dahmane, F.;
Tadjer, A.;
Doumi, B.;
Aourag, H.

Publication type:

Article

Pairing Symmetry, Spin Gap, and More in HTSC Cuprates.

Published in:

Journal of Superconductivity & Novel Magnetism, 2014, v. 27, n. 9, p. 1973, doi. 10.1007/s10948-014-2549-5

By:

Dayan, Moshe

Publication type:

Article

Unconventional Magnetic Transition in NaCoO ( x>0.7) Single Crystals.

Published in:

Journal of Superconductivity & Novel Magnetism, 2014, v. 27, n. 5, p. 1235, doi. 10.1007/s10948-013-2406-y

By:

Li, Qiuhang;
Zhang, Yuanyuan;
Xu, Mingxiang

Publication type:

Article

Electrical and Magnetic Behaviour of PrFeAsO $_{\mathbf{0.8}}$F $_{\mathbf{0.2}}$ Superconductor.

Published in:

Journal of Superconductivity & Novel Magnetism, 2014, v. 27, n. 3, p. 687, doi. 10.1007/s10948-013-2358-2

By:

Meena, R.;
Pal, Anand;
Rao, K.;
Kishan, Hari;
Awana, V.

Publication type:

Article

A First Principle Study of CoCrZ (Z=In, Sn, Sb) Based on FP-LAPW Method.

Published in:

Journal of Superconductivity & Novel Magnetism, 2013, v. 26, n. 12, p. 3507, doi. 10.1007/s10948-013-2224-2

By:

Rai, D.;
Thapa, R.

Publication type:

Article

Magnetic Correlations in Some FeNi/Cu(100) Multilayers.

Published in:

Journal of Superconductivity & Novel Magnetism, 2013, v. 26, n. 5, p. 1983, doi. 10.1007/s10948-012-2062-7

By:

Assaad, Rula;
Razee, S.

Publication type:

Article

Stable Organic (Bi)Radicals by Delocalization of Spin Density into the Electron‐Poor Chromophore Core of Isoindigo.

Published in:

Chemistry - A European Journal, 2018, v. 24, n. 14, p. 3420, doi. 10.1002/chem.201706002

By:

Rausch, Rodger;
Schmidt, David;
Bialas, David;
Würthner, Frank;
Krummenacher, Ivo;
Braunschweig, Holger

Publication type:

Article

Spin polarized density functional theory calculations of the electronic structure and magnetism of the 112 type iron pnictide compound EuFeAs2.

Published in:

Scientific Reports, 2021, v. 11, n. 1, p. 1, doi. 10.1038/s41598-021-91301-4

By:

Nejadsattari, Farshad;
Stadnik, Zbigniew M.

Publication type:

Article

First-principles calculations for the structural and electronic properties of GaAsP nanowires.

Published in:

International Journal of Modern Physics C: Computational Physics & Physical Computation, 2016, v. 27, n. 3, p. -1, doi. 10.1142/S0129183116500352

By:

Mohammad, Rezek;
Katırcıoğlu, Şenay

Publication type:

Article

A Systematic Study of Structural, Magneto-Electronic and Thermodynamic Properties of Mg1−xCrxSe DMS Alloys in the Rock–Salt Phase for Spintronic Applications.

Published in:

Journal of Electronic Materials, 2019, v. 48, n. 5, p. 3248, doi. 10.1007/s11664-019-07043-7

By:

Bordjiba, Zeyneb;
Meddour, Athmane;
Bourouis, Chahrazed

Publication type:

Article

Control of Exchange Interactions in π Dimers of 6-Oxophenalenoxyl Neutral π Radicals: Spin-Density Distributions and Multicentered-Two-Electron Bonding Governed by Topological Symmetry and Substitution at the 8-Position.

Published in:

Chemistry - A European Journal, 2013, v. 19, n. 36, p. 11904, doi. 10.1002/chem.201301783

By:

Nishida, Shinsuke;
Kawai, Junya;
Moriguchi, Miki;
Ohba, Tomohiro;
Haneda, Naoki;
Fukui, Kozo;
Fuyuhiro, Akira;
Shiomi, Daisuke;
Sato, Kazunobu;
Takui, Takeji;
Nakasuji, Kazuhiro;
Morita, Yasushi

Publication type:

Article

Electronic instabilities of the AA-honeycomb bilayer.

Published in:

Annalen der Physik, 2014, v. 526, n. 9/10, p. 366, doi. 10.1002/andp.201400088

By:

de la Peña, David Sánchez;
Scherer, Michael M.;
Honerkamp, Carsten

Publication type:

Article

The iron-sulfur core in Rieske proteins is not symmetric.

Published in:

Journal of Biological Inorganic Chemistry (JBIC), 2014, v. 19, n. 8, p. 1287, doi. 10.1007/s00775-014-1185-7

By:

Ali, Md.;
Nair, Nisanth;
Retegan, Marius;
Neese, Frank;
Staemmler, Volker;
Marx, Dominik

Publication type:

Article

Metallic Ferromagnetic Property of Mn-Doped BP Semiconductors.

Published in:

Journal of Molecular & Engineering Materials, 2021, v. 9, n. 1n2, p. 1, doi. 10.1142/S2251237321300011

By:

Boutaleb, M.;
Tadjer, A.

Publication type:

Article

Theoretical Studies on Ethylene Selectivity in the Oxidative.

Published in:

Chemistry - An Asian Journal, 2013, v. 8, n. 11, p. 2605, doi. 10.1002/asia.201300410

By:

Li, Bo;
Su, Dangsheng

Publication type:

Article

Sensor applications of polypyrrole for oxynitrogen analytes: a DFT study.

Published in:

Journal of Molecular Modeling, 2018, v. 24, n. 11, p. 1, doi. 10.1007/s00894-018-3843-0

By:

Wasim, Fatima;
Kosar, Naveen;
Mahmood, Tariq;
Ayub, Khurshid

Publication type:

Article

Theoretical investigation of the mechanism for the reductive dehalogenation of methyl halides mediated by the CoI-based compounds cobalamin and cobaloxime.

Published in:

Journal of Molecular Modeling, 2018, v. 24, n. 11, p. 1, doi. 10.1007/s00894-018-3844-z

By:

Terán, Julio E.;
Zambrano, Cesar H.;
Mora, Jose R.;
Rincón, L.;
Torres, F. J.

Publication type:

Article

A structural DFT study of MM, GG, MG, and GM alginic acid disaccharides and reactivity of the MG metallic complexes.

Published in:

Journal of Molecular Modeling, 2018, v. 24, n. 11, p. 1, doi. 10.1007/s00894-018-3845-y

By:

Bekri, Lahcène;
Zouaoui-Rabah, Mourad;
Springborg, Michael;
Rahal, Majda Sekkal

Publication type:

Article

On the best partitioning of the density functional energy.

Published in:

Journal of Molecular Modeling, 2018, v. 24, n. 11, p. 1, doi. 10.1007/s00894-018-3842-1

By:

Levy, Mel

Publication type:

Article

Spectral separation of optical spin based on antisymmetric Fano resonances.

Published in:

Scientific Reports, 2015, p. 16585, doi. 10.1038/srep16585

By:

Piao, Xianji;
Yu, Sunkyu;
Hong, Jiho;
Park, Namkyoo

Publication type:

Article

Distinct itinerant spin-density waves and local-moment antiferromagnetism in an intermetallic ErPd2Si2 single crystal.

Published in:

Scientific Reports, 2015, p. 7968, doi. 10.1038/srep07968

By:

Li, Hai-Feng;
Cao, Chongde;
Wildes, Andrew;
Schmidt, Wolfgang;
Schmalzl, Karin;
Hou, Binyang;
Regnault, Louis-Pierre;
Zhang, Cong;
Meuffels, Paul;
Löser, Wolfgang;
Roth, Georg

Publication type:

Article

A Note on First Order Phase Transitions in the Continuum.

Published in:

Journal of Statistical Physics, 2016, v. 162, n. 4, p. 994, doi. 10.1007/s10955-015-1435-2

By:

Cassandro, M.;
Presutti, E.

Publication type:

Article

Anisotropic spin-density distribution and magnetic anisotropy of strained La1−xSrxMnO3 thin films: angle-dependent x-ray magnetic circular dichroism.

Published in:

NPJ Quantum Materials, 2018, v. 3, n. 1, p. N.PAG, doi. 10.1038/s41535-018-0077-4

By:

Shibata, Goro;
Kitamura, Miho;
Minohara, Makoto;
Yoshimatsu, Kohei;
Kadono, Toshiharu;
Ishigami, Keisuke;
Harano, Takayuki;
Takahashi, Yukio;
Sakamoto, Shoya;
Nonaka, Yosuke;
Ikeda, Keisuke;
Chi, Zhendong;
Furuse, Mitsuho;
Fuchino, Shuichiro;
Okano, Makoto;
Fujihira, Jun-ichi;
Uchida, Akira;
Watanabe, Kazunori;
Fujihira, Hideyuki;
Fujihira, Seiichi

Publication type:

Article

Structural investigations in BaFe2 − xRu xAs2 as a function of Ru and temperature.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2015, v. 71, n. 1, p. 61, doi. 10.1107/S2052520614023634

By:

Sharma, Shilpam;
Bharathi, A.;
Vinod, K.;
Sundar, C. S.;
Srihari, V.;
Sen, Smritijit;
Ghosh, Haranath;
Sinha, Anil K.;
Deb, S. K.

Publication type:

Article

Electronic Structure for Europium Chalcogenides with Modified Becke–Johnson Potential Plus an On-Site Coulomb U (mBJ+U).

Published in:

SPIN (2010-3247), 2018, v. 8, n. 4, p. N.PAG, doi. 10.1142/S2010324718500157

By:

Belhachi, S.

Publication type:

Article

Spin-filtering and charge- and spin-switching effects in a quantum wire with periodically attached stubs.

Published in:

European Physical Journal B: Condensed Matter, 2014, v. 87, n. 1, p. 1, doi. 10.1140/epjb/e2013-40963-7

By:

Xiao, X.;
Chen, Z.;
Liu, Z.;
Li, H.;
Nie, W.;
Zhang, C.;
Zhou, G.

Publication type:

Article

Anisotropy of Magnetoresistance in HoB12.

Published in:

Acta Physica Polonica: A, 2017, v. 131, n. 4, p. 976, doi. 10.12693/APhysPolA.131.976

By:

KHOROSHILOV, A.;
KRASNORUSSKY, V.;
BOGACH, A.;
GLUSHKOV, V.;
DEMISHEV, S.;
LEVCHENKO, A.;
SHITSEVALOVA, N.;
FILIPOV, V.;
GABÁNI, S.;
FLACHBART, K.;
ANISIMOV, M.;
SIEMENSMEYERE, K.;
SLUCHANKO, N.

Publication type:

Article

Temperature Dependence of a Dielectric Relaxation in Weakly Polar Ferrofluids.

Published in:

Acta Physica Polonica: A, 2017, v. 131, n. 4, p. 943, doi. 10.12693/APhysPolA.131.943

By:

RAJŇÁK, M.;
KURIMSKÝ, J.;
DOLNÍK, B.;
CIMBALA, R.;
PAULOVIČOVÁ, K.;
KOPČANSKÝ, P.;
TIMKO, M.

Publication type:

Article

Angular Magnetoresistance of a Possible Kondo Insulator CeOs4Sb12 Measured at Ultra-Low Temperatures.

Published in:

Acta Physica Polonica: A, 2016, v. 130, n. 2, p. 600, doi. 10.12693/APhysPolA.130.600

By:

BOCHENEK, Ł.;
CICHOREK, T.

Publication type:

Article

Derivation of ligand σ- and π-bonding parameters from density functional theoretical calculations and Bursten ligand additivity relationships.

Published in:

Journal of Coordination Chemistry, 2013, v. 66, n. 9, p. 1477, doi. 10.1080/00958972.2013.781161

By:

Graham, JohnP.

Publication type:

Article

Commensurate and incommensurate states of a spin density wave in a quasi-two-dimensional system with an anisotropic energy spectrum in an external magnetic field of arbitrary direction relative to magnetization.

Published in:

Journal of Experimental & Theoretical Physics, 2013, v. 116, n. 4, p. 641, doi. 10.1134/S1063776113040080

By:

Palistrant, M.;
Ursu, V.

Publication type:

Article

Coexistence of spin density wave and superconductivity in BaFe2-xCoxAs2.

Published in:

Latin-American Journal of Physics Education, 2015, v. 9, n. 2, p. 1

By:

Tekle, Gebremeskel;
Kahsay, Gebregziabher

Publication type:

Article

Charge exchange response functions of finite nucleus by an extended Skyrme interaction.

Published in:

International Journal of Modern Physics E: Nuclear Physics, 2014, v. 23, n. 6, p. -1, doi. 10.1142/S0218301314600015

By:

Wen, Pei-Wei;
Cao, Li-Gang

Publication type:

Article

Weakening of the spin density wave gap at low temperatures in single crystals.

Published in:

Physica Status Solidi (B), 2016, v. 253, n. 2, p. 340, doi. 10.1002/pssb.201552463

By:

Dutta, Anirban;
Kumar, Neeraj;
Thamizhavel, A.;
Gupta, Anjan K.

Publication type:

Article

Works matching DE "SPIN-density functional theory"

Skyrmions in a density wave state: A mechanism for chiral superconductivity.

Thermodynamic Properties of Superconductor with Competing Spin-Density Wave and Charge-Density Wave.

First-Principle Calculations of Structural, Electronic, and Magnetic Properties of Cubic Al TMN (TM = V, Cr, Mn, Fe).

Pairing Symmetry, Spin Gap, and More in HTSC Cuprates.

Unconventional Magnetic Transition in NaCoO ( x>0.7) Single Crystals.

Electrical and Magnetic Behaviour of PrFeAsO $_{\mathbf{0.8}}$F $_{\mathbf{0.2}}$ Superconductor.

A First Principle Study of CoCrZ (Z=In, Sn, Sb) Based on FP-LAPW Method.

Magnetic Correlations in Some FeNi/Cu(100) Multilayers.

Stable Organic (Bi)Radicals by Delocalization of Spin Density into the Electron‐Poor Chromophore Core of Isoindigo.

Spin polarized density functional theory calculations of the electronic structure and magnetism of the 112 type iron pnictide compound EuFeAs2.

First-principles calculations for the structural and electronic properties of GaAsP nanowires.

A Systematic Study of Structural, Magneto-Electronic and Thermodynamic Properties of Mg<sub>1−x</sub>Cr<sub>x</sub>Se DMS Alloys in the Rock–Salt Phase for Spintronic Applications.

Control of Exchange Interactions in π Dimers of 6-Oxophenalenoxyl Neutral π Radicals: Spin-Density Distributions and Multicentered-Two-Electron Bonding Governed by Topological Symmetry and Substitution at the 8-Position.

Electronic instabilities of the AA-honeycomb bilayer.

The iron-sulfur core in Rieske proteins is not symmetric.

Metallic Ferromagnetic Property of Mn-Doped BP Semiconductors.

Theoretical Studies on Ethylene Selectivity in the Oxidative.

Sensor applications of polypyrrole for oxynitrogen analytes: a DFT study.

Theoretical investigation of the mechanism for the reductive dehalogenation of methyl halides mediated by the Co<sup>I</sup>-based compounds cobalamin and cobaloxime.

A structural DFT study of MM, GG, MG, and GM alginic acid disaccharides and reactivity of the MG metallic complexes.

On the best partitioning of the density functional energy.

Spectral separation of optical spin based on antisymmetric Fano resonances.

Distinct itinerant spin-density waves and local-moment antiferromagnetism in an intermetallic ErPd<sub>2</sub>Si<sub>2</sub> single crystal.

A Note on First Order Phase Transitions in the Continuum.

Anisotropic spin-density distribution and magnetic anisotropy of strained La<sub>1−x</sub>Sr<sub>x</sub>MnO<sub>3</sub> thin films: angle-dependent x-ray magnetic circular dichroism.

Structural investigations in BaFe<sub>2 − x</sub>Ru<sub> x</sub>As<sub>2</sub> as a function of Ru and temperature.

Electronic Structure for Europium Chalcogenides with Modified Becke–Johnson Potential Plus an On-Site Coulomb U (mBJ+U).

Spin-filtering and charge- and spin-switching effects in a quantum wire with periodically attached stubs.

Anisotropy of Magnetoresistance in HoB<sub>12</sub>.

Temperature Dependence of a Dielectric Relaxation in Weakly Polar Ferrofluids.

Angular Magnetoresistance of a Possible Kondo Insulator CeOs<sub>4</sub>Sb<sub>12</sub> Measured at Ultra-Low Temperatures.

Derivation of ligand σ- and π-bonding parameters from density functional theoretical calculations and Bursten ligand additivity relationships.

Commensurate and incommensurate states of a spin density wave in a quasi-two-dimensional system with an anisotropic energy spectrum in an external magnetic field of arbitrary direction relative to magnetization.

Coexistence of spin density wave and superconductivity in BaFe<sub>2-x</sub>Co<sub>x</sub>As<sub>2</sub>.

Charge exchange response functions of finite nucleus by an extended Skyrme interaction.

Weakening of the spin density wave gap at low temperatures in single crystals.