Standout Papers

Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximatio... 1992 2026 2003 2014 19.3k
  1. Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation (1992)
    John P. Perdew, J. A. Chevary et al. Physical review. B, Condensed matter
  2. BoltzTraP. A code for calculating band-structure dependent quantities (2006)
    Georg K. H. Madsen, David J. Singh Computer Physics Communications
  3. Unconventional Superconductivity with a Sign Reversal in the Order Parameter ofLaFeAsO1−xFx (2008)
    I. I. Mazin, David J. Singh et al. Physical Review Letters
  4. An alternative way of linearizing the augmented plane-wave method (2000)
    E. Sjöstedt, Lars Nordström et al. Solid State Communications
  5. Superconductivity at 22 K in Co-DopedBaFe2As2Crystals (2008)
    Athena S. Sefat, Rongying Jin et al. Physical Review Letters
  6. Planewaves, Pseudopotentials and the LAPW Method (2006)
    David J. Singh et al. Digital Access to Libraries (Université catholique de Louvain (UCL), l'Université de Namur (UNamur) and the Université Saint-Louis (USL-B))
  7. Electronic structure and half-metallic transport in theLa1−xCaxMnO3system (1996)
    Warren E. Pickett, David J. Singh Physical review. B, Condensed matter
  8. Giant anharmonic phonon scattering in PbTe (2011)
    Olivier Delaire, Jie Ma et al. Nature Materials
  9. Ground-state properties of lanthanum: Treatment of extended-core states (1991)
    David J. Singh Physical review. B, Condensed matter
  10. Light scattering and surface plasmons on small spherical particles (2014)
    Xiaofeng Fan, Weitao Zheng et al. Light Science & Applications
  11. On the tuning of electrical and thermal transport in thermoelectrics: an integrated theory–experiment perspective (2016)
    Jiong Yang, Lili Xi et al. npj Computational Materials
  12. Giant optical anisotropy in a quasi-one-dimensional crystal (2018)
    Shanyuan Niu, Graham Joe et al. Nature Photonics
  13. Coordination Number Regulation of Molybdenum Single-Atom Nanozyme Peroxidase-like Specificity (2020)
    Ying Wang, Guangri Jia et al. Chem
  14. Room-temperature intrinsic ferromagnetism in epitaxial CrTe2 ultrathin films (2021)
    Xiaoqian Zhang, Qiangsheng Lu et al. Nature Communications

Immediate Impact

3 by Nobel laureates 68 from Science/Nature 247 standout
Sub-graph 1 of 16

Citing Papers

Pseudo-nanostructure and trapped-hole release induce high thermoelectric performance in PbTe
2024 StandoutScience
Plasticity in single-crystalline Mg3Bi2 thermoelectric material
2024 StandoutNature
115 intermediate papers

Works of David J. Singh being referenced

High-throughput deformation potential and electrical transport calculations
2023
Electronic structure calculations with the Tran-Blaha modified Becke-Johnson density functional
2010
and 54 more

Author Peers

Author Last Decade Papers Cites
David J. Singh 37054 21552 13845 14901 630 58.4k
David Vanderbilt 49611 19889 15261 18640 361 74.4k
Fujio Izumi 25742 14767 10126 12683 254 41.8k
L. J. Sham 33088 10666 8907 18511 258 69.4k
Chris J. Pickard 31867 9225 5446 9812 309 47.0k
M. C. Payne 32800 9515 4234 12899 214 49.0k
C. N. R. Rao 52851 28784 12837 20251 1.5k 81.6k
Matthias Scheffler 32957 5873 5885 14682 486 52.8k
Alex Zunger 56060 13495 12474 39387 732 84.4k
Peter Blaha 21529 12649 7746 9455 361 32.8k
Hendrik J. Monkhorst 45082 11389 6899 19396 122 65.6k

All Works

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2026