Publications

2023

  • Spiral band structure hidden in the bulk chiral crystal NbSi2. C. Zhang, T. Shishidou, R. Amano, K. Miyamoto, T. Sayo, C. Shimada, Y. Kousaka, M. Weinert, Y. Togawa, and T. Okuda, Phys. Rev. B 108, 235164 (2023). Link
  • Superconductivity of anomalous pseudospin in nonsymmorphic materials. H. G. Suh, Y. Yu, T. Shishidou, M. Weinert, P. M. R. Brydon, and D. F. Agterberg, Phys. Rev. Research 5, 033204 (2023). Link
  • Revealing the hidden spin-polarized bands in a superconducting Tl bilayer crystal. T. Kobayashi, Y. Toichi, K. Yaji, Y. Nakata, Y. Yaoita, M. Iwaoka, M. Koga, Y. Zhang, J. Fujii, S. Ono, Y. Sassa, Y. Yoshida, Y. Hasegawa, F. Komori, S. Shin, S. Ichinokura, R. Akiyama, S. Hasegawa, T. Shishidou, M. Weinert, and K. Sakamoto, Nano Lett. 23, 7675 (2023). Link
  • Giant periodic pseudomagnetic fields in strained Kagome magnet FeSn epitaxial films on SrTiO3(111) substrate. H. Zhang, M. Weinert, and L. Li, Nano Lett. 23, 2397 (2023). Link
  • Two-dimensional crystal phases of graphene monoxide. D. Radevych, M. Gajdardziska-Josifovska, and M. Weinert, Phys. Rev. B 107, 054104 (2023). Link

2022

  • Impenetrable barrier at the metal-Mott insulator junction in polymorphic 1H and 1T NbSe2 lateral heterostructure. H. Zhang, C. Yan, Z. Ge, M. Weinert, and L. Li, J. Phys. Chem. Lett. 13, 10713 (2022). Link
  • β-graphene monoxide: Two-dimensional crystal form of carbon monoxide. D. Radevych, M. Gajdardziska-Josifovska, C. J. Hirschmugl, M. A. Schofield, and M. Weinert, Phys. Rev. Materials 6, 074006 (2022). Link
  • Nano-faceted stabilization of polar-oxide thin films: The case of MgO(111) and NiO(111) surfaces. A. Kerrigan, K. Pande, D. Pingstone, S. A. Cavill, M. Gajdardziska-Josifovska, K. P. McKenna, M. Weinert, and V. K. Lazarov, Applied Surface Science 596, 153490 (2022). Link
  • Nonsymmorphic symmetry and field-driven odd-parity pairing in CeRh2As2. D. C. Cavanagh, T. Shishidou, M. Weinert, P. M. R. Brydon, and Daniel F. Agterberg, Phys. Rev. B 105, L020505 (2022). Link  (Editors’ Suggestion)

2021

  • Atomic-layer stacking dependence of the magnetocrystalline anisotropy in Fe-Co multilayer thin films at MgO(001) interface. K. Nakamura, K. Nozaki, K. Hayashi, A.-M. Pradipto, M. Weinert, and T. Oguchi, J. Magn. Magn. Mater. 537, 168175 (2021). Link
  • Strong-coupling anisotropic s-wave superconductivity in the type-II Weyl semimetal TaIrTe4. D. Tang, Y. Chen, M. Yang, Q. Wang, Y. Zou, X. Wang, Z. Li, C. Yi, Y. Shi, X. Kong, G. Song, Y. Xu, X. Wei, M. Weinert, L. Li, W. Fang, and Y. Liu, Phys. Rev. B 103, 174508 (2021). Link
  • Interaction of lithium with a monolayer of graphene monoxide. D. Radevych, M. Gajdardziska-Josifovska, C. J. Hirschmugl, and M. Weinert, J. Phys. Chem. C 125, 11820 (2021). Link
  • Binding of oxygen on single-atom sites on Au/Pd(100) alloys with high gold coverages. N. Hopper, T. Thuening, S. Manzi, M. Weinert, and W. Tysoe, J. Phys. Chem. C 125, 9715 (2021). Link
  • Topological band and superconductivity in UTe2. T. Shishidou, Han Gyeol Suh, P. M. R. Brydon, M. Weinert, and D. F. Agterberg, Phys. Rev. B 103, 104504 (2021). Link

2020

  • Orbital Angular Momentum Induced Spin Polarization of 2D Metallic Bands. T. Kobayashi, Y. Nakata, K. Yaji, T. Shishidou, D. Agterberg, S. Yoshizawa, F. Komori, S. Shin, M. Weinert, T. Uchihashi, and K. Sakamoto, Phys. Rev. Lett. 125, 176401 (2020). Link
  • Exchange splitting and exchange-induced nonreciprocal photonic behavior of graphene in CrI3-graphene van der Waals heterostructures. A. M. Holmes, S. Pakniyat, S. A. Hassani Gangaraj, F. Monticone, M. Weinert, and G. W. Hanson, Phys. Rev. B 102, 075435 (2020). Link
  • Superconductivity on edge: Evidence of a one-dimensional superconducting channel at the edges of single-layer FeTeSe antiferromagnetic nanoribbons. Z. Ge, Q. Zou, H. Zhang, C. Yan, D. Agterberg, M. Weinert, and L. Li, ACS Nano 14, 6539 (2020). Link
  • Sign changing pairing in single layer FeSe/SrTiO3 revealed by nonmagnetic impurity bound states. H. Zhang, Z. Ge, M. Weinert, and L. Li, Commun. Phys. 3, 75 (2020). Link
  • Topological edge states at single layer WSe2 1T’-1H lateral heterojunctions. Chenhui Yan, Huiming Zhang, Michael Weinert, and Lian Li, Appl. Phys. Lett. 116, 203104 (2020). Link
  • Probing the outermost layer of thin gold films by XPS and density functional theory. Cristiana Passiu, Antonella Rossi, Michael Weinert, Wilfred Tysoe, and Nicholas D. Spencer, Applied Surface Science 507, 145084 (2020). Link
  • Terahertz response of gadolinium gallium garnet (GGG) and gadolinium scandium gallium garnet (SGGG). M. Sabbaghi, G. W. Hanson, M. Weinert, F. Shi, and C. Cen, J. Appl. Phys. 127, 025104 (2020). Link

2019

  • Observation of orbital angular momentum in the chiral magnet CrNb3S6 by soft x-ray magnetic circular dichroism. M. Mito, H. Ohsumi, T. Shishidou, F. Kuroda, M. Weinert, K. Tsuruta, Y. Kotani, T. Nakamura, Y. Togawa, J. Kishine, Y. Kousaka, J. Akimitsu, and K. Inoue, Phys. Rev. B 99, 174439 (2019). Link
  • Interplay of paramagnetism and topology in the Fe-chalcogenide high-Tc superconductors. J. D. Rameau, N. Zaki, G. D. Gu, P. D. Johnson, and M. Weinert, Phys. Rev. B 99, 205117 (2019). Link
  • Evidence for d-wave superconductivity in single layer FeSe/SrTiO3 probed by quasiparticle scattering off step edges. Z. Ge, C. Yan, H. Zhang, D. Agterberg, M. Weinert, and L. Li, Nano Lett. 19, 2497 (2019). Link
  • One-dimensional metallic edge states of oxygen-terminated zigzag graphene edges. Y. Y. Li, M. X. Chen, M. Weinert, L. Li, 2D Materials 6, 025038 (2019). Link

2018

  • Termination-dependent edge states of MBE-grown WSe2, L. Liu, Z. Ge, C. Yan, A. D. Moghadam, M. Weinert, and L. Li, Phys. Rev. B 98, 235304 (2018). Link
  • Layer k-projection and unfolding electronic bands at interfaces. M. X. Chen and M. Weinert, Phys. Rev. B 98, 245421 (2018). Link
  • Magnetic fluctuations in single-layer FeSe. T. Shishidou, D. F. Agterberg, and M. Weinert, Commun. Phys. 1, 8 (2018). Link
  • Symmetric and asymmetric exchange stiffnesses of transition-metal thin film interfaces in external electric field. K. Nakamura, A.-M. Pradipto, T. Akiyama, T. Ito, T. Oguchi, and M. Weinert, J. Magnetism and Magnetic Materials 457, 97 (2018). Link
  • Scaled effective on-site Coulomb interaction in the DFT+U method for correlated materials. K. Nawa, T. Akiyama, T. Ito, K. Nakamura, T. Oguchi, and M. Weinert, Phys. Rev. B 97, 035117 (2018). Link

2017

  • Resilient nodeless d-wave superconductivity in monolayer FeSe. D. F. Agterberg, T. Shishidou, J. O’Halloran, P. M. R. Brydon, and M. Weinert, Phys. Rev. Lett. 119, 267001 (2017). Link
  • Effects of magnetic dopants in (Li0.8M0.2OH)FeSe (M = Fe, Mn, Co): Density-functional theory study using a band unfolding technique. M. X. Chen, W. Chen, Z. Zhang, and M. Weinert, Phys. Rev. B 96, 245111 (2017). Link
  • Engineering the magnetic properties of zigzag graphene nanoribbon by epoxy chains. H. H. Pu, S. H. Rhim, M. Gajdardziksa-Josifovska, C. J. Hirschmugl, M. Weinert, and J. H. Chen, Mater. Res. Express 4, 085008 (2017). Link
  • Stabilizing the spin vortex crystal phase in two-dimensional iron-based superconductors. J. O’Halloran, D. F. Agterberg, M. X. Chen, and M. Weinert, Phys. Rev. B 95, 075104 (2017). Link

2016

  • Effects of interface oxygen vacancies on electronic bands of FeSe/SrTiO3(001). M. X. Chen, Zhuozhi Ge, Y. Y. Li, D. F. Agterberg, L. Li, and M. Weinert, Phys. Rev. B 94, 245139 (2016). Link
  • Indirect Interlayer Bonding in Graphene-Topological Insulator van der Waals Heterostructure: Giant Spin-Orbit Splitting of the Graphene Dirac States. S. Rajput, Y. Y. Li, M. Weinert, and L. Li, ACS Nano 10, 8450 (2016). Link
  • Designing substrates for silicene and germanene: First-principles calculations. M. X. Chen, M. Weinert, and Z. Zhong, Phys. Rev. B 94, 075409 (2016). Link
  • Half-metallic Dirac cone in zigzag graphene nanoribbons on graphene. M. X. Chen and M. Weinert, Phys. Rev. B 94, 035433 (2016). Link
  • Search for the ground-state electronic configurations of correlated organometallic metallocenes from constraint density functional theory. K. Nawa, Y. Kitaoka, K. Nakamura, H. Imamura, T. Akiyama, T. Ito, and M. Weinert, Phys. Rev. B 94, 035136 (2016). Link
  • Pairing of j=3/2 Fermions in Half-Heusler Superconductors. P. M. R. Brydon, Limin Wang, M. Weinert, and D. F. Agterberg, Phys. Rev. Lett. 116, 177001 (2016). Link

2015

  • Spin-orbit interactions and the nematicity observed in the Fe-based superconductors. P. D. Johnson, H.-B. Yang, J. D. Rameau, G. D. Gu, Z.-H. Pan, T. Valla, M. Weinert, and A. V. Fedorov, Phys. Rev. Lett. 114, 167001 (2015). Link
  • Electric-Field-Induced Modification of the Magnon Energy, Exchange Interaction, and Curie Temperature of Transition-Metal Thin Films. M. Oba, K. Nakamura, T. Akiyama, T. Ito, M. Weinert, and A. J. Freeman, Phys. Rev. Lett. 114, 107202 (2015). Link
  • Determining charge state of graphene vacancy by noncontact atomic force microscopy and first-principles calculations. Y. Liu, M. Weinert, and L. Li, Nanotechnology 26, 035702 (2015). Link
  • Investigation of NO2 adsorption on reduced graphene oxide. E. C. Mattson, K. Pande, S. Cui, M. Weinert, J. H. Chen, and C. J. Hirschmugl, Chem. Phys. Lett. 622, 86-91 (2015). Link

2014

  • Revealing the substrate origin of the linear dispersion of silicene/Ag(111). M. X. Chen and M. Weinert, Nano Letters 14, 5189 (2014). Link
  • A statistical thermodynamics model for monolayer gas adsorption on graphene-based materials: implications for gas sensing applications. H. Pu, S. Rhim, M. Gajdardziska-Josifovska, C. Hirschmugl, M. Weinert, and J. Chen, RSC Advances 4, 47481-47487 (2014). Link
  • Direct experimental determination of onset of electron-electron interactions in gap opening of zigzag graphene nanoribbons. Y. Y. Li, M. X. Chen, M. Weinert, and L. Li, Nature Communications 5, 4311 (2014). Link
  • Tuning Dirac states by strain in the topological insulator Bi2Se3. Y. Liu, Y. Y. Li, S. Rajput, D. Gilks, L. Lari, P. L. Galindo, M. Weinert, V. K. Lazarov, and L. Li, Nature Physics 10, 294-299 (2014). Link
  • Vibrational excitations and low-energy electronic structure of epoxide-decorated graphene. E. C. Mattson, J. E. Johns, K. Pande, R. A. Bosch, S. Cui , M. Gajdardziska-Josifovska, M. Weinert, J. H. Chen, M. C. Hersam, and C. J. Hirschmugl, J. Phys. Chem. Lett. 5, 212-219 (2014). Link

2013

  • Spatial fluctuations in barrier height at the graphene–silicon carbide Schottky junction. S. Rajput, M.X. Chen, Y. Liu, Y.Y. Li, M. Weinert, and L. Li, Nature Communications 4, 2752 (2013). Link
  • Electric-field-driven hole carriers and superconductivity in diamond. K. Nakamura, S. H. Rhim, A. Sugiyama, K. Sano, T. Akiyama, T. Ito, M. Weinert, and A. J. Freeman, Phys. Rev. B 87, 214506 (2013). Link
  • Exploring adsorption and reactivity of NH3 on reduced graphene oxide. E. C. Mattson, K. Pande, M. Unger, S. Cui, G. Lu, M. Gajdardziska-Josifovska, M. Weinert, J. Chen, and C. J. Hirschmugl, J. Phys. Chem. C 117 10698 (2013). Link
  • Excited Cr impurity states in Al2O3 from constraint density functional theory. Y. Kitaoka, K. Nakamura, T. Akiyama, T. Ito, M. Weinert, and A. J. Freeman, Phys. Rev. B 87, 205113 (2013). Link
  • Charging Dirac states at antiphase domain boundaries in the three-dimensional topological insulator Bi2Se3. Y. Liu, Y. Y. Li, D. Gilks, V. K. Lazarov, M. Weinert, and L. Li, Phys. Rev. Lett. 110, 186804 (2013). Link
  • Strain-induced band-gap engineering of graphene monoxide and its effect on graphene. H. H. Pu, S. H. Rhim, C. J. Hirschmugl, M. Gajdardziska-Josifovska, M. Weinert, and J. H. Chen, Phys. Rev. B 87, 085417 (2013). Link
  • Dielectric constant of NiO and LDA+U. L.-H. Ye, N. Luo, L.-M. Peng, M. Weinert, and A. J. Freeman, Phys. Rev. B 87, 075115 (2013). Link
  • Pressure dependence of the shear strengths of the tungsten carbide-potassium chloride interface. M. T. Garvey, M. Weinert, and W. T. Tysoe, Tribology Letters 50, 105 (2013). Link
  • Indium-doped SnO2 nanoparticle–graphene nanohybrids: simple one-pot synthesis and their selective detection of NO2. S. Cui, Z. Wen, E. C. Mattson, S. Mao, J. Chang, M. Weinert, C. J. Hirschmugl, M. Gajdardziska-Josifovska, and J. Chen, J. Mater. Chem. A 1, 4462 (2013). Link
  • Anisotropic thermal conductivity of semiconducting graphene monoxide. H. H. Pu, S. H. Rhim, C. J. Hirschmugl, M. Gajdardziska-Josifovska, M. Weinert, and J. H. Chen, Appl. Phys. Lett. 102, 223101 (2013). Link
  • First-principles studies on infrared properties of semiconducting graphene monoxide. H. H. Pu, E. C. Mattson, S. H. Rhim, M. M. Gajdardziksa-Josifovska, C. J. Hirschmugl, M. Weinert and J. H. Chen, J. Appl. Phys.114, 164313 (2013). Link

2012

  • On the film thickness dependence of shear strengths in sliding, boundary-layer friction. M. Garvey, M. Weinert, and W. T. Tysoe, Wear 274-275, 281 (2012). Link
  • Formation of nitrogen-vacancy complexes during plasma-assisted nitrogen doping of epitaxial graphene on SiC(0001). S. H. Rhim, Y. Qi, Y. Liu, M. Weinert, and L. Li, Appl. Phys. Lett. 100, 233119 (2012). Link
  • Strain and structure driven complex magnetic ordering of a CoO overlayer on Ir(100). F. Mittendorfer, M. Weinert, R. Podloucky, and J. Redinger, Phys. Rev. Lett. 109, 015501 (2012). Link
  • Spiral growth without dislocations: Molecular beam epitaxy of the topological insulator Bi2Se3 on epitaxial graphene/SiC(0001). Y. Liu, M. Weinert, and L. Li, Phys. Rev. Lett. 108, 115501 (2012). Link
  • Incommensurate Moirè overlayer with strong local binding: CoO(111) bilayer on Ir(100). C. Tröppner, T. Schmitt, M. Reuschl, L. Hammer, M.A. Schneider, F. Mittendorfer, J. Redinger, R. Podloucky, and M. Weinert, Phys. Rev. B 86, 235407 (2012). Link
  • Atomic and electronic structure of polar hematite(0001)/MgO(111) Interfaces. K. Pande, M. Gajdardziska-Josifovska, and M. Weinert, Phys. Rev. B 86, 035431 (2012). Link
  • Constraint density functional calculations for multiplets in a ligand-field applied to Fe-phthalocyanine. K. Nakamura, Y. Kitaoka, T. Akiyama, T. Ito, M. Weinert, and A. J. Freeman, Phys. Rev. B 85, 235129 (2012). Link
  • Structural and magnetic properties of MBE-grown GeMnN2 thin films. Y. Liu, V. K. Lazarov, S. H. Cheung, D. J. Keavney, M. Gajdardziska-Josifovska, M. Weinert, and L. Li, Phys. Rev. B 85, 144113 (2012). Link
  • Role of nitrogen split interstitial defects in the magnetic properties of Cu-doped GaN. Y. Liu, Z. Gai, M. Weinert, and L. Li, Phys. Rev. B 85, 075207 (2012). Link
  • Effects of unreconstructed and reconstructed polar surface terminations on growth, structure, and magnetic properties of hematite films. S. H. Cheung, A. Celik-Aktas, P. Dey, K. Pande, M. Weinert, B. Kabius, D. J. Keavney, V. K. Lazarov, S. Chambers, and M. Gajdardziska-Josifovska, Phys. Rev. B 85, 045405 (2012). Link
  • Ag nanocrystals as a promoter for carbon nanotube-based room-temperature gas sensors. S. Cui, H. Pu, E. Mattson, G. Lu, M. Weinert, C. Hirschmugl, M. Gajdardziska-Josifovska, and J. Chen, Nanoscale 4, 5887 (2012). Link
  • Fast and selective room-temperature ammonia sensors using Silver nanocrystals-functionalized carbon nanotubes. S. Cui, H. Pu, G. Lu, Z. Wen, E. Mattson, C. Hirschmugl, M. Gajdardziska-Josifovska, M. Weinert, and J. Chen, ACS Applied Materials & Interfaces 4, 4898 (2012). Link

2011

  • Electric field-induced modification of magnetocrystalline anisotropy in transition-metal films and at metal-insulator Interfaces. K. Nakamura, T. Akiyama, T. Ito, M. Weinert, and A. J. Freeman, J. Magnetics 16, 161 (2011). Link
  • Structure of Methyl Pyruvate and α-(1-Naphthyl)ethylamine on Pd(111). L. Burkholder, M. Garvey, M. Weinert, and W. Tysoe, J. Phys. Chem. C 115, 8790 (2011). Link
  • Shear properties of potassium chloride films on iron using density functional theory. M. Garvey, O. J. Furlong, M. Weinert, and W. T. Tysoe, J. Physics: Condensed Matter 23, 265003 (2011) [IOP Select]. Link
  • Dynamically stabilized growth of polar oxides: The case of MgO(111). V. K. Lazarov, Z. Cai, K. Yoshida, H. Lee, M. Weinert, K. S. Ziemer, and P. J. Hasnip, Phys. Rev. Lett. 107, 056101 (2011). Link
  • Role of functionalized transition-metal coated W tips in STM imaging: Application to epitaxial graphene on SiC(0001), S. H. Rhim, Y. Qi, G. F. Sun, M. Weinert, L. Li, Phys. Rev. B 84, 125425 (2011). Link
  • On the pressure dependence of shear strengths in sliding, boundary-layer friction. M. Garvey, M. Weinert, and W. T. Tysoe, Tribology Letters 4, 67 (2011). Link
  • Si diffusion path for pit-free graphene growth on SiC(0001). G. F. Sun, Y. Liu, S. H. Rhim, J. F. Jia, Q. K. Xue, M. Weinert, and L. Li, Phys. Rev. B 84, 195455 (2011). Link
  • Creation of low-coordination gold sites on the Au(111) surface by para-diisocyanobenzene Adsorption, J. Boscoboinik, J. Kestell, M. Garvey, M. Weinert and W. T. Tysoe, Topics in Catalysis 54, 20 (2011). Link
  • Evidence of nanocrystalline semiconducting graphene monoxide during thermal reduction of graphene oxide in vacuum. E. C. Mattson, H. Pu, S. Cui, M. A. Schofield, S. H. Rhim, G. Lu, M. J. Nasse, R. S. Ruoff, M. Weinert, M. Gajdardziska-Josifovska, J. Chen, and C. J. Hirschmugl, ACS Nano 5, 9710 (2011). Link

2010

  • Role of an interfacial FeO layer in the electric-field-driven switching of magnetocrystalline anisotropy at the Fe/MgO interface. K. Nakamura, T. Akiyama, T. Ito, M. Weinert, and A. J. Freeman, Phys. Rev. B 81, 220409(R) (2010). Link
  • Epitaxial graphene on SiC(0001): More than just honeycombs. Y. Qi, S. H. Rhim, G. F. Sun, M. Weinert, and L. Li, Phys. Rev. Lett. 105, 085502 (2010). Link
  • Electron standing waves on the GaN(0001)-pseudo (1×1) surface: a FT-STM study at room temperature. G. F. Sun, Y. Liu, Y. Qi, J. F. Jia, Q.-K. Xue, M. Weinert, and L Li, Nanotechnology 21, 435401 (2010). Link

2009

  • FLAPW: Applications and implementations. M. Weinert, G. Schneider, R. Podloucky, and J. Redinger, J. Phys. Condens. Matter 21, 084201 (2009). Link
  • Electronic structures of Mn-induced phases on GaN(0001). Y. Qi, G. F. Sun, M. Weinert, and L. Li, Phys. Rev. B 80, 235323 (2009). Link
  • Convergence Test of the Full-potential Linearized Augmented Plane Wave (FLAPW) method: Ferromagnetic bulk bcc Fe. S.-W. Seo, Y. Y. Song, G. Rahman, I. G. Kim, M. Weinert, and A. J. Freeman, J. Magnetics 14, 137 (2009). Link

2008

  • Incorporation of Ge on GaN(0001). Y. Qi, S. T. King, S. H. Cheung, M. Weinert, and L. Li, Appl. Phys. Lett. 92, 111918 (2008). Link
  • Observation of ferromagnetic surface of paramagnetic YCo2. Y. S. Dedkov, C. Laubschat, S. Khmelevskyi, J. Redinger, P. Mohn, and M. Weinert, J. Phys. Conf. Ser. 100, 072028 (2008). Link

2007

  • YCo2: Intrinsic Magnetic Surface of a Paramagnetic Bulk Material. Yu. S. Dedkov, C. Laubschat, S. Khmelevskyi, J. Redinger, P. Mohn, and M. Weinert, Phys. Rev. Lett. 99, 047204 (2007). Link
  • Atomistic view of the autosurfactant effect during GaN epitaxy. S. T. King, M. Weinert, and L. Li, Phys. Rev. Lett. 98, 206106 (2007). Link

2006

  • Magnetic instability and meta-magentism on the surface of the bulk paramagnetic intermetallic compound YCo2. S. Khmelevskyi, P. Mohn, J. Redinger, and M. Weinert, Physica B 378-380, 109 (2006). Link
  • Unusual adsorption site of hydrogen on the unreconstructed Ir(100) surface. D. Lerch, A. Klein, A. Schmidt, S. Müller, L. Hammer, K. Heinz, and M. Weinert, Phys. Rev. B 73, 075430 (2006). Link

2005

  • X-ray absorption near-edge structure analysis of the chemical environment of zinc in the tribological film formed by zinc dialkyl dithiophosphate decompisiton on steel. M. D. Pauli, T. S. Rufasel, J. K. Mowlen, M. Weinert, D. K. Saldin, and W. T. Tysoe, Tribology International 38, 195 (2005). Link
  • Ultrahigh vacuum study of the requirements for formation of a chiral template. D. Stacchiola, L. Burkholder, T. Zheng, M. Weinert, and W. T. Tysoe, J. Phys. Chem. B 109, 851 (2005). Link
  • Structure of the hydrogen stabilized MgO(111)-(1×1) polar surface: Integrated experimental and theoretical studies. V. K. Lazarov, R. A. Plass, H-C. Poon, D. K. Saldin, M. Weinert, S. A. Chambers, and M. Gajdardziska-Josifovska, Phys. Rev. B 71, 115434 (2005). Link
  • Role of Ga polarization and defect sites in the magnetism of Mn-doped GaN. D. J. Keavney, S. H. Cheung, S. T. King, M. Weinert, and L. Li,& Phys. Rev. Lett. 95, 257201 (2005). Link
  • Selected growth of cubic and hexagonal GaN epitaxial films on polar MgO(111). V. K. Lazarov, J. Zimmerman, S. H. Cheung, L. Li, M. Weinert, and M. Gajdardziska-Josifovska, Phys. Rev. Lett.94, 216101 (2005). Link
  • Magnetism on the surface of the bulk paramagnetic intermetallic compound YCo2. S. Khmelevskyi, P. Mohn, J. Redinger, and M. Weinert, Phys. Rev. Lett. 94, 146403 (2005). Link
  • Atomic and electronic structure of the Fe3O4/MgO(111) model polar oxide interface. V. K. Lazarov, M. Weinert, S. A. Chambers, and M. Gajdardziska-Josifovska, Phys. Rev. B 72, 195401 (2005). Link

2004

  • Structure determination of disordered organic molecules on surfaces from the Bragg spots of low-energy diffraction and total-energy calculations. T. Zheng, W. T. Tysoe, H. C. Poon, M. Weinert, and D. K. Saldin, Phys. Rev. B 69, 035401 (2004). Link

2003

  • Giant Coster-Kronig transitions and intrinsic line shapes of the anomalous Pd M4,5VV Auger spectrum of Pd/Ag(100) dilute surface alloys. D. A. Arena, R.A. Bartynski, R.A. Nayak, A.H. Weiss, S. L. Hulbert, and M. Weinert, Phys. Rev. Lett. 91, 176403 (2003). Link

2002

  • Density-functional theory and atomic multiplet levels. M. Weinert, R. E. Watson, and G. W. Fernando, Phys. Rev. A 66, 032508 (2002). Link
  • Transition-metal aluminide formation: The 4d aluminides. R. E. Watson, M. Weinert, and M. Alatalo, Phys. Rev. B 65, 014103 (2002). Link
  • Spin-resolved photoemission study of photohole lifetimes in ferromagnetic gadolinium. A. V. Fedorov, T. Valla, F. Liu, P. D. Johnson, M. Weinert, and P. B. Allen, Phys. Rev. B 65, 212409 (2002). Link

2001

  • Transition-metals and their alloys. R. E. Watson and M. Weinert, Solid State Physics, Vol. 56, H. Ehrenreich and F. Spaepen, eds. (Academic Press, San Diego, 2001) pp. 1-112.
  • Electronic structure and thermodynamics of defects in NiAl3. M. Rasamny, M. Weinert, G. W. Fernando, and R. E. Watson, Phys. Rev. B 64, 144107 (2001). Link

2000

  • First-principles calculations of the self-trapped exciton in crystalline NaCl. V. Perebeinos, P. B. Allen, and M. Weinert, Phys. Rev. B 62, 12589 (2000). Link
  • Magnetic moment of iron in metallic environments. G. W. Fernando, R. E. Watson, M. Weinert, A. N. Kocharian, A. Ratnaweera, and K. Tennakone, Phys. Rev. B 61, 375 (2000). Link
  • The Hume-Rothery parameters and bonding in the Hume-Rothery and transition-metal alloys. R. E. Watson, M. Weinert, and L. H. Bennett, The Science of Alloys for the 21th Century, P. E. A. Turchi, R. D. Shull, and A. Gonis, eds. (TMS, Warrendale, PA, 2000), pp. 105-119.
  • Bonding in Metals. R. E. Watson and M. Weinert, Methods in Materials Research, 2a.4.1-2a.4.12 (Wiley, NY, 2000).

1999

  • Thickness induced buckling of bcc Cu films. B. M. Ocko, I. K. Robinson, M. Weinert, R. J. Randler, and D. M. Kolb, Phys. Rev. Lett. 83, 780 (1999). Link
  • Truncated pseudopotentials for alloy calculations. M. Alatalo, M. Weinert, and R. E. Watson, Phys. Rev. B 60, 7680 (1999). Link
  • Force constants for substitutional alloys. M. H. F. Sluiter, M. Weinert, and Y. Kawazoe, Phys. Rev. B 59, 4100 (1999). Link
  • Electric field-induced changes in scanning tunneling microscopy images of metals. S. Heinze, X. Nie, S. Blügel, and M. Weinert, Chem. Phys. Lett. 315, 167 (1999). Link

1998

  • Enthalpies of formation of NiAl: Experiment versus theory. K. Rzyman, Z. Moser, R. E. Watson, and M. Weinert, J. Phase Equilibria 19, 106 (1998). Link
  • Determination of the elastic tensor in low symmetry structures. M. H. F. Sluiter, M. Weinert, and Y. Kawazoe, Euro. Phys. Lett. 43, 183 (1998). Link
  • Potassium adsorption and an unoccupied surface state on Fe(001).& P. D. Johnson, Y. Chang, N. B. Brookes, and M. Weinert, J. Phys. Condensed Matter 10, 95 (1998). Link
  • Hybridization-induced bandgaps in transition-metal aluminides. M. Weinert and R. E. Watson, Phys. Rev. B 58, 9732 (1998). Link
  • Reversible depression in the Tc of thin Nb films due to enhanced hydrogen absorption. N. M. Jisrawi, M. W. Ruckman, T. R. Thurston, G. Reisfeld, M. Weinert, and M. Strongin, Phys. Rev. B 58, 6585 (1998). Link
  • Transition-metal aluminide formation: Ti, V, Fe, and Ni aluminides. R. E. Watson and M. Weinert, Phys. Rev. B 58, 5981 (1998). Link
  • Ternary transition metal-aluminide alloy formation: The BiF3 structure. R. E. Watson, M. Weinert, and M. Alatalo, Phys. Rev. B 57, 12134 (1998). Link
  • XANES study of hydrogen incorporation in a Pd-capped Nb thin film. M. W. Ruckman, G. Reisfeld, N. M. Jisrawi, M. Weinert, M. Strongin, H. Wiesmann, M. Croft, A. Sahiner, D. Sills, and P. Ansari, Phys. Rev. B 57, 3881 (1998). Link
  • Stability of Zr-Al alloys. M. Alatalo, M. Weinert, and R. E. Watson, Phys. Rev. B 57, R2009 (1998). Link

1997

  • Stacking faults in magnesium. N. Chetty and M. Weinert, Phys. Rev. B 56, 10844 (1997). Link
  • Structural instabilities of excited phases. P. J. Craievich, J. M. Sanchez, R. E. Watson, and M. Weinert, Phys. Rev. B 55, 787 (1997). Link
  • Stoner criterion of ferromagnetism and moment saturation in the Hubbard model with an applied magnetic field. G. W. Fernando, A. N. Kocharian, R. E. Watson, and M. Weinert, Physica B 230-232, 509 (1997). Link

1996

  • First-principles study of titanium oxides. C. Leung, M. Weinert, P. B. Allen, and R. M. Wenzcovitch, Phys. Rev. B 54, 7857 (1996). Link
  • Enthalpies of formation of Ni3Al: Experiment versus theory. K. Rzyman, Z. Moser, R. E. Watson, and M. Weinert, J. Phase Equilibria 17, 173 (1996). Link
  • On the role of classical and quantum notions in channeling and the development of fast positrons as a solid state probe of valence electron and spin densities. L. V. Hau, J. A. Golovchenko, R. Haakenaasen, A. W. Hunt, J. P. Peng, P. Asoka-Kumar, K. G. Lynn, M. Weinert, and J. C. Palathingal, Nucl. Instr. Meth. B 119, 30 (1996). Link

1995

  • Vacancies and impurities in aluminum and magnesium. N. Chetty, M. Weinert, T. S. Rahman, and J. W. Davenport, Phys. Rev. B 52, 6313 (1995). Link
  • Core level shifts in bulk alloys and surface adlayers. M. Weinert and R. E. Watson, Phys. Rev. B 51, 17168 (1995). Link
  • Electronic structure of Au and Ag overlayers on Ru(001): The behavior of the noble metal d bands. A. Bzowski, T. K. Sham, R. E. Watson, and M. Weinert, Phys. Rev. B 51, 9979 (1995). Link
  • Tunneling spectroscopy of bcc(001) surface states. J. A. Stroscio, D. T. Pierce, A. Davies, R. J. Celotta, and M. Weinert, Phys. Rev. Lett. 75, 2960 (1995). Link

1994

  • First-principles calculations of magnetic interfaces and multilayers. M. Weinert and S. Blügel, Magnetic Multilayers, edited by L. H. Bennett and R. E. Watson
    (World Scientific, Singapore 1994), pp. 51-83. Link
  • Charge transfer in gold-alkali systems. R. E. Watson and M. Weinert, Phys. Rev. B 49, 7148 (1994). Link
  • The metallic bond for monolayer transition metal layers on transition metal surfaces. M. Strongin, M. W. Ruckman, M. Weinert, R. E. Watson, and J. W. Davenport, Metallic Alloys: Experimental and Theoretical Perspectives, J. S. Faulkner and R. G. Jordan, editors (Kluwer Academic, Netherlands, 1994) pp. 37-46.
  • Point group symmetries and Gaussian integration. G. W. Fernando, M. Weinert, R. E. Watson, and J. W. Davenport, J. Computational Physics 112, 282 (1994). Link
  • First-principles pseudopotential calculations on aluminum and aluminum alloys. J. W. Davenport, N. Chetty, R. B. Marr, S. Narasimhan, J. E. Pasciak, R. F. Peierls, and M. Weinert, Alloy Modeling and Design, G. M. Stocks and P. E. A. Turchi, eds., (The Minerals, Metals, and Materials Society, Warrendale, PA, 1994), pp. 3-12.
  • Energetics of ordered intermetallic alloys of transition metals. R. E. Watson, M. Weinert, J. W. Davenport, G. W. Fernando, and L. H. Bennett, Statics and Dynamics of Alloy Phase Transformations, eds. P. E. A. Turchi and A. Gonis (Plenum Press, NY 1994) pp.227-68.
  • Local stability of non-equilibrium phases. P. J. Craievich, M. Weinert, J. M. Sanchez, and R. E. Watson, Phys. Rev. Lett. 72, 3076 (1994). Link
  • Alloy heats of formation: Theory versus experiment. R. E. Watson, M. Weinert, J. W. Davenport, and G. W. Fernando, J. Phase Equilibria 15, 273 (1994). Link

1993

  • Magnetic energy anomalies of 3d systems. T. Hoshino, R. Zeller, P. H. Dederichs, and M. Weinert, Europhys. Lett. 24, 495 (1993). Link
  • Cu/Pd multilayers: An atomistic structural study. G. W. Fernando, J. Mei, R. E. Watson, M. Weinert, and J. W. Davenport, Phys. Rev. B 47, 13636 (1993). Link
  • Comment on “Ferromagnetism of the Rh(001) surface”. M. Weinert, S. Blügel, and P. D. Johnson, Phys. Rev. Lett. 71, 4097 (1993). Link

1992

  • Energetics of metal-metal interfaces. M. Weinert, R. E. Watson, J. W. Davenport, and G. W. Fernando. Ordering at Surfaces and Interfaces, A. Yoshimori, T. Shinjo, and H. Watanabe, editors, pp. 321-328 (Springer-Verlag, Berlin, 1992).
  • Fractional occupations and density functional energies and forces. M. Weinert and J. W. Davenport, Phys. Rev. B 45, 13709 (1992). Link
  • Surface electronic structure and interatomic Auger transitions on TaC(111) observed with Auger photoelectron coincidence spectroscopy. R. A. Bartynski, S. Yang, S. L. Hulbert, C.-C. Kao, M. Weinert, and D. M. Zehner, Phys. Rev. Lett. 68, 2247 (1992). Link
  • First-principles calculations: The elemental transition metals and their compounds. R. E. Watson, G. W. Fernando, M. Weinert, and J. W. Davenport, J. Phase Equilibria 13, 244 (1992). Link
  • Heats of formation of transition metal alloys: The full-potential approach and the Pt-Ti system. G. W. Fernando, R. E. Watson, and M. Weinert, Phys. Rev. B 45, 8233 (1992). Link

1991

  • Local-density approximation: Cohesion in the transition metals and sd promotion in transition-metal atoms. R. E. Watson, G. W. Fernando, M. Weinert, Y. J. Wang, and J. W. Davenport, Phys. Rev. B 43, 1455 (1991). Link
  • Charge transfer in transition-metal alloying: Charge-tailing effects. R. E. Watson, M. Weinert, and G. W. Fernando, Phys. Rev. B 43, 1446 (1991). Link
  • A comparison of the surface electronic structure of Ta(100) and TaC(111) using Auger-photoelectron coincidence spectroscopy (APECS). S. L. Hulbert, C. C. Kao, R. F. Garrett, R. A. Bartynski, S. Yang, M. Weinert, E. Jensen, and D. M. Zehner, J. Vac. Sci. Tech. A9, 1919 (1991). Link
  • Surface electronic structure of GaAs(110) studied by Auger photoelectron coincidence spectroscopy. R. A. Bartynski, E. Jensen, K. Garrison, S. L. Hulbert, and M. Weinert, J. Vac. Sci. Tech. A9, 1907 (1991). Link
  • Recent progress in electronic structure calculations for defects in metals. R.Zeller, B. Drittler, P. H. Dederichs, U. Klemradt, and M. Weinert. Computer Aided Innovation of New Materials, M. Doyama, T. Suzuki, J. Kihara, and R. Yamamoto, editors, pp. 269-274 (Elsevier Science Publishers B. V., North-Holland, 1991).
  • Charge transfer, charge tailing, cohesion, and electron promotion in the transition metals. R. E. Watson, M. Weinert, G. W. Fernando, and J. W. Davenport, Physica B 172, 289 (1991). Link
  • Cohesion and promotion energies in the transition metals: Implications of the local-density approximation. R. E. Watson, G. W. Fernando, M. Weinert, Y. J. Wang, and J. W. Davenport, J. Appl. Phys. 69, 5688 (1991). Link
  • Vacancy formation energies of fcc transition metals calculated by a full potential Green’s function method. B. Drittler, M. Weinert, R. Zeller, and P. H. Dederichs, Solid State Comm. 79, 31 (1991). Link
  • First-principles simulations of metallic alloys and liquids. J. W. Davenport, G. W. Fernando, G.-X. Qian, R. E. Watson, and M. Weinert, Proceedings of the First Energy Research Power Supercomputer Users Symposium, CONF-9105202 (National Technical Information Service, U.S. Department of Commerce, 1991).

1990

  • Calculation of hyperfine interaction parameters in metals: Friedel oscillations in dilute Fe and Cu alloys. P. H. Dederichs, B. Drittler, R. Zeller, H. Ebert, and M. Weinert, Hyperfine Interactions 60, 547 (1990). Link
  • Electronic structure of transition metal alloys and intermetallics: Charge transfer and its implication for Mössbauer effect measurements. R. E. Watson, J. W. Davenport, M. Weinert, and G. W. Fernando, Hyperfine Interactions 53, 213 (1990). Link
  • First-principles calculation of the activation energy for diffusion in liquid sodium. Guo-Xin Qian, M. Weinert, G. W. Fernando, and J. W. Davenport, Phys. Rev. Lett. 64, 1146 (1990). Link
  • Electric-field gradients in dilute Cu alloys: The role of the Cu d electrons. B. Drittler, M. Weinert, R. Zeller, and P. H. Dederichs, Phys. Rev. B 42, 9336 (1990). Link
  • Surface resonances on Ta(001). X. Pan, E. W. Plummer, and M. Weinert, Phys. Rev. B 42, 5025 (1990). Link
  • Observation of surface to bulk interatomic Auger decay from Ta(001). E.Jensen, R. A. Bartynski, M. Weinert, S. L. Hulbert, E. D. Johnson, and R. Garrett, Phys. Rev. B 41, 12468 (1990). Link
  • Cohesion and lattice stabilities in the 5d transition metals: Full versus muffin-tin potentials. G. W. Fernando, R. E. Watson, M. Weinert, Y. J. Wang, and J. W. Davenport, Phys. Rev. B 41, 11813 (1990). Link
  • Spin-polarized photoemission studies of the adsorption of O and S on Fe(001). A. Clarke, N. B. Brookes, P. D. Johnson, M. Weinert, B. Sinkovic, and N. V. Smith, Phys. Rev. B 41, 9659 (1990). Link
  • Magnetic surface states on Fe(001). N. B. Brookes, A. Clarke, P. D. Johnson, and M. Weinert, Phys. Rev. B 41 2643 (1990). Link
  • First-principles molecular dynamics studies of liquid and solid sodium. J. W. Davenport, G. X. Qian, G. W. Fernando, and M. Weinert, International Journal of Supercomputer Applications 4, 122 (1990). Link

1989

  • Modelling and theories of alloy phase behavior. R. E. Watson, J. W. Davenport, M. Weinert, and L. H. Bennett in Thermochemistry of Alloys, H. Brodowsky and H.-J. Schaller, eds. (Kluwer Academic, 1989) pp. 1-28.
  • First-principles molecular dynamics for metals. G. W. Fernando, Guo-Xin Qian, M. Weinert, and J. W. Davenport, Phys. Rev. B 40, 7985 (1989). Link
  • Distance of the image plane from metal surfaces. N. V. Smith, C. T. Chen, and M. Weinert, Phys. Rev. B 40, 7565 (1989). Link
  • Full-potential linearized augmented Slater-type orbital method. G. W. Fernando, J. W. Davenport, R. E. Watson, and M. Weinert, Phys. Rev. B 40, 2757 (1989). Link
  • Adsorbed layer and multilayer materials: The energetics and bonding of Pd and Ag on Nb(001) and Nb(110). M. Weinert, R. E. Watson, J. W. Davenport, and G. W. Fernando, Phys. Rev. B 39, 12585 (1989). Link
  • Energetics of transition metal alloy formation: Ti, Zr, and Hf alloyed with the heavier 4d and 5d elements. R. E. Watson, M. Weinert, J. W. Davenport, and G. W. Fernando, Phys. Rev. B 39, 10761 (1989). Link
  • Two-dimensional angular correlation of annihilation radiation study of positron interactions with surfaces of aluminum. D. M. Chen, S. Berko, K. F. Canter, K. G. Lynn, A. P. Mills, L. O. Roellig, P. Sferlazzo, M. Weinert, and R. N. West, Phys. Rev. B 39, 3966 (1989). Link
  • First-principles calculation of impurity solution energies in Cu and Ni. B. Drittler, M. Weinert, R. Zeller, and P. H. Dederichs, Phys. Rev. B 39, 930 (1989). Link
  • Antiferromagnetism of CuO2 layers. M. Weinert and G. W. Fernando, Phys. Rev. B 39, 835 (1989). Link
  • Magnetic overlayers on Pd. S. Blügel, M. Weinert, and P. H. Dederichs, Physica Scripta T25, 301 (1989). Link
  • Energetics associated with the formation of interfaces, multilayers, and adlayers. R. E. Watson, M. Weinert, J. W. Davenport, and G. W. Fernando, in Proceedings of the Material Research Society Symposium 1988, Vol. 141, 405 (Boston, 1989).

1988

  • Ferro- and antiferromagnetism of 3d-overlayers on metals. S. Blügel, M. Weinert, and P. H. Dederichs, Phys. Rev. Lett. 60, 1077 (1988). Link
  • Localized states at metal–metal interfaces: An inverse photoemission study of Pd on Nb(110). X. Pan, P. D. Johnson, M. Weinert, R. E. Watson, J. W. Davenport, G. W. Fernando, and S. L. Hulbert, Phys. Rev. B 38, 7850 (1988). Link
  • Structural stability of rhenium as a function of lattice compression: Theory. R. E. Watson, J. W. Davenport, M. Weinert, and G. W. Fernando, Phys. Rev. B 38, 7817 (1988). Link
  • Linearized augmented Slater-type orbital method for electronic structure calculations. V. Spin-orbit splitting in Cu3Au. J. W. Davenport, R. E. Watson, and M. Weinert, Phys. Rev. B 37, 9985 (1988). Link
  • Surface barrier for electrons in metals. P. J. Jennings, R. O. Jones, and M. Weinert, Phys. Rev. B 37, 6113 (1988). Link
  • Energetics of transition metal alloy formation: Theory versus experiment. R. E. Watson, M. Weinert, J. W. Davenport, and G. W. Fernando, Scripta Metallurgica 22, 1285 (1988). Link

1987

  • Comment on the structure of Au(110). J. W. Davenport and M. Weinert, Phys. Rev. Lett. 58, 1382 (1987). Link
  • Angle-resolved positronium emission spectroscopy. D. M. Chen, S. Berko, K. F. Canter, K. G. Lynn, A. P. Mills, L. O. Roellig, P. Sferlazzo, M. Weinert, and R. N. West, Phys. Rev. Lett. 58, 921 (1987). Link
  • Linearized augmented Slater-type orbital study of Pt-5d transition metal alloying. R. E. Watson, J. W. Davenport, and M. Weinert, Phys. Rev. B 36, 6396 (1987). Link
  • Structural stabilities of layered materials: Pt-Ta. R. E. Watson, M. Weinert, and J. W. Davenport, Phys. Rev. B 35, 9284 (1987). Link
  • Linear augmented Slater-type orbital study of Au 5d-transition metal alloying. R. E. Watson, J. W. Davenport, and M. Weinert, Phys. Rev. B 35, 508 (1987). Link
  • Hyperfine fields at surfaces and interfaces. A. J. Freeman, C. L. Fu, M. Weinert, and S. Ohnishi, Hyperfine Interactions 33, 53 (1987). Link
  • Electronic aspects of the H/W(001) surface phase transitions. M. Weinert in Proceedings of the 17th International Symposium on Electronic Structure (Dresden, 1987) pp. 72-6.

1986

  • Icosahedral ordering: A microscopic view of the mass density wave description. R. E. Watson and M. Weinert, Mat. Sci. and Eng. 79, 105 (1986). Link
  • H and the W(001) surface reconstructions: Local bonding to surface states. M. Weinert, A. J. Freeman, and S. Ohnishi, Phys. Rev. Lett. 56, 2295 (1986). Link
  • Electronic structure of the (2×2)C p4g carbidic phase on Ni(100). C. F. McConville, D. P. Woodruff, S. D. Kevan, M. Weinert, and J. W. Davenport, Phys. Rev. B 34, 2199 (1986). Link
  • Final state screening of core holes in metals. M. Weinert, J. W. Davenport, and R. E. Watson, Phys. Rev. B 34, 2971 (1986). Link
  • Linear augmented Slater-type orbital method for electronic structure calculations. IV 5d-5d alloys. R. E. Watson, J. W. Davenport, and M. Weinert, Phys. Rev. B 34, 8421 (1986). Link
  • Local atomic environments in periodic and icosahedral aperiodic Al-Mn alloys. L. H. Bennett, M. Kuriyama, G. G. Long, M. Melamud, R. E. Watson, and M. Weinert, Phys. Rev. B 34, 8270 (1986). Link
  • High-resolution inverse-photoemission study of the Pd(111) surface. S. L. Hulbert, P. D. Johnson, and M. Weinert, Phys. Rev. B 34, 3670 (1986). Link
  • Unoccupied surface states on Cu(001): A comparison of experiment and theory. S. L. Hulbert, P. D. Johnson, M. Weinert, and R. F. Garrett, Phys. Rev. B 33, 760 (1986). Link
  • Electron band theory predictions and the construction of phase diagrams. R. E. Watson, L. H. Bennett, J. W. Davenport, and M. Weinert in Computer Modeling of Phase Diagrams, L. H. Bennett, ed. (AIME, 1986), p. 223.

1985

  • Theoretical determination of surface magnetism. M. Weinert, A. J. Freeman, S. Ohnishi, and J. W. Davenport, J. Appl. Phys. 57, 3641 (1985). Link
  • Resolution of an apparent paradox in the physics of Fermi levels. M. Weinert, Solid State Commun. 54, 513 (1985). Link
  • Image planes and surface states. M. Weinert, S. L. Hulbert, and P. D. Johnson, Phys. Rev. Lett. 55, 2055 (1985). Link
  • Frozen-phonon total energy determination of structural surface phase transitions: W(001). C. L. Fu, A. J. Freeman, E. Wimmer, and M. Weinert, Phys. Rev. Lett. 54, 2261 (1985). Link
  • Chemisorption of H on magnetic Ni(001). M. Weinert and J. W. Davenport, Phys. Rev. Lett. 54, 1547 (1985). Link
  • Linearized augmented-plane-wave calculation of the electronic structure and total energy of tungsten. S. H. Wei, H. Krakauer, and M. Weinert, Phys. Rev. B 32, 7792 (1985). Link
  • Linear augmented Slater-type orbital method for electronic structure calculations. III. Structural and cohesive energies of the 5d elements Lu-Au. J. W. Davenport, R. E. Watson, and M. Weinert, Phys. Rev. B 32, 4883 (1985). Link
  • Linear augmented Slater-type orbital calculations. II. bcc, fcc, hcp W. J. W. Davenport, M. Weinert, and R. E. Watson, Phys. Rev. B 32, 4876 (1985). Link
  • Total-energy differences and eigenvalue sums. M. Weinert, R. E. Watson, and J. W. Davenport, Phys. Rev. B 32, 2115 (1985). Link
  • Electronic and Magnetic Structure of Solid Surfaces. A. J. Freeman, C. L. Fu, S. Ohnishi, and M. Weinert, in Polarized Electrons in Surface Physics, edited by R. Feder (World Scientific, Singapore, 1985), pp. 3-66.
  • Cohesive and structural energies for the 5d elements, Lu through Au. J. W. Davenport, R. E. Watson, and M. Weinert, Phys. Scr. 32, 425 (1985). Link

1984

  • Contribution of electronic excitations to the entropy of crystals: Relative stabilities of the hcp, fcc, and bcc structures among transition metals. R. E. Watson and M. Weinert, Phys. Rev. B 30, 1641 (1984). Link
  • Interface magnetism in metals: Ag/Fe(001). S. Ohnishi, M. Weinert, and A. J. Freeman, Phys. Rev. B 30, 36 (1984). Link
  • Contributions to the workfunctions of crystals. M. Weinert and R. E. Watson, Phys. Rev. B 29, 3001 (1984). Link
  • Interaction of helium with a graphite surface. A. Liebsch, J. Harris, and M. Weinert, Surf. Sci. 145, 207 (1984). Link
  • Electronic structure near metal-metal interfaces. J. W. Davenport and M. Weinert, Surf. Sci. 144, 220 (1984). Link
  • Theory of hyperfine anomalies in muonic atoms. A. J. Freeman, J. V. Mallow, J. P. Desclaux, and M. Weinert, Hyperfine Interactions 19, 865 (1984). Link
  • Electronic structure and magnetism of surfaces, interfaces, and modulated structures (superlattices). A. J. Freeman, T. Jarlborg, H. Krakauer, S. Ohnishi, D. S. Wang, E. Wimmer, and M. Weinert, Hyperfine Interactions 18, 413 (1984). Link
  • Local density approach to surfaces and adsorbed layers. E. Wimmer, A. J. Freeman, and M. Weinert, in Proceedings of the Symposium on Local Density Approximations in Quantum Chemistry and Solid State Theory, Copenhagen 1982, edited by J. Avery and J. P. Dahl (Plenum, NY 1984), pp. 593-604.

1983

  • Prediction of electronic interlayer states in graphite and the reinterpretation of alkali bands in graphite intercalation compounds. M. Posternak, A. Baldereschi, A. J. Freeman, E. Wimmer, and M. Weinert, Phys. Rev. Lett. 50, 761 (1983). Link
  • Free-electron interlayer states in pure and Li-intercalated graphite. M. Posternak, A. Baldereschi, A. J. Freeman, E. Wimmer, and M. Weinert, in Intercalated Graphite (North Holland, NY 1983), pp. 117-122.
  • Surface magnetism of Fe(001). S. Ohnishi, A. J. Freeman, and M. Weinert, Phys. Rev. B 28, 6741 (1983). Link
  • Relativistic spin-polarization and magnetization: Knight shift of Pt(001). M. Weinert and A. J. Freeman, Phys. Rev. B 28, 6262 (1983). Link
  • Phase transitions in a mercury monolayer. H. J. F. Jansen, A. J. Freeman, M. Weinert, and E. Wimmer, Phys. Rev. B 28, 593 (1983). Link
  • Total energy assessment of the quality of localized basis sets: O2 molecule. B. Delley, A. J. Freeman, M. Weinert, and E. Wimmer, Phys. Rev. B 27, 6509 (1983). Link
  • Magnetism at surfaces and interfaces. A. J. Freeman, H. Krakauer, S. Ohnishi, D. S. Wang, M. Weinert, and E. Wimmer, J. Mag. Magn. Mat. 38, 269 (1983). Link
  • Magnetism of linear chains. M. Weinert and A. J. Freeman, J. Mag. Magn. Mat. 38, 23 (1983). Link
  • All-electron self-consistent determination of spin-polarization and Knight shift of a Pt(001) film. D. S. Wang, A. J. Freeman, and M. Weinert, J. Mag. Magn. Mat. 31-34, 891 (1983). Link
  • Self-consistent FLAPW determination of surface magnetism: Fe(001). S. Ohnishi, A. J. Freeman, and M. Weinert, J. Mag. Magn. Mat. 31-34, 889 (1983). Link

1982

  • Cesiation of W(001): Work function lowering by multiple dipole formation. E. Wimmer, A. J. Freeman, M. Weinert, H. Krakauer, J. R. Hiskes, and A. M. Karo, Phys. Rev. Lett. 48, 1128 (1982). Link
  • Total energy all-electron density functional method for bulk solids and surfaces. M. Weinert, E. Wimmer, and A. J. Freeman, Phys. Rev. B 26, 4571 (1982). Link
  • Magnetism at surfaces and interfaces. A. J. Freeman, H. Krakauer, S. Ohnishi, D. S. Wang, M. Weinert, and E. Wimmer, J. de Physique 43, C7-167 (1982).

1981

  • Theoretical 2p-core level shift and crystal field splitting at the Al(001) surface. E. Wimmer, M. Weinert, A. J. Freeman, and H. Krakauer, Phys. Rev. B 24, 2292 (1981). Link
  • Solution of Poisson’s equation: Beyond Ewald-type methods. M. Weinert, J. Math. Phys. 22, 2433 (1981). Link
  • Full-potential self-consistent linearized-augmented-plane-wave method for calculating the electronic structure of molecules and surfaces: O2 molecule. E. Wimmer, H. Krakauer, M. Weinert, and A. J. Freeman, Phys. Rev. B 24, 864 (1981). Link
  • Spin-polarized bandstructure determination of the Si2 molecular ground state by the method of full-potential linearized augmented-planewaves. M. Weinert, E. Wimmer, A. J. Freeman, and H. Krakauer, Phys. Rev. Lett. 47, 705 (1981). Link
  • Relativistic self-consistent field theory for muonic atoms: The muonic hyperfine anomaly. J. V. Mallow, J. P. Desclaux, A. J. Freeman, and M. Weinert, Hyperfine Interactions 8, 455 (1981). Link

1980

  • Breit interaction determination of muonic hyperfine anomalies: Large but not giant. A. J. Freeman, M. Weinert, J. P. Desclaux, and J. V. Mallow, J. Mag. Magn. Mat. 22, L1 (1980). Link

1979

  • Electronic structure of CuCl. A. J. Freeman, C. S. Wang, T. Jarlborg, M. Weinert, F. Wagner, and C. W. Chu, Int. J. Quantum Chem. S13, 445 (1979). Link

nano-2015 nphys14-1cover-prl prbv87i810_thumbna2143-webcover