J. Gale
Materials Chemistry · Chemical Society Reviews · 2003–2020
A researcher in the Science corpus: 9 papers; trusts 3 researchers and is trusted by 18 researchers here, as inferred from the citation graph.
Subfields
- Materials Chemistry — 57 citations into it; #1,097 of 11,513 by trust here, #5,537 by citations
- Atomic and Molecular Physics, and Optics — 50 citations into it
- Electrical and Electronic Engineering — 32 citations into it
Whom J. Gale trusts overall
Their strongest outbound trust, strongest first, inferred from their citations.
- David F. Shanno
- Roger Fletcher
- Roberto Car
- Arthur F. Voter
- Adri C. T. van Duin
- Bernard R. Brooks
- Michele Parrinello
- M. Powell
- Alexander L. Shluger
- M. Islam
Who trusts J. Gale overall
- Hans Senn
- E. Schauble
- Walter Thiel
- Baoling Huang
- M. J. Qomi
- Kirill Okhotnikov
- David Dubbeldam
- Nick R. Papior
- H. Sheng
- J. A. Flores-Livas
Papers from J. Gale's perspective
Ordered by how strongly the researchers J. Gale trusts endorse each paper. Same corpus, a different order for every researcher.
- A smooth particle mesh Ewald method
- Phonons and related crystal properties from density-functional perturbation theory
- A Rapidly Convergent Descent Method for Minimization
- Density-functional exchange-energy approximation with correct asymptotic behavior.
- Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density.
- Ab initio molecular simulations with numeric atom-centered orbitals
- Unified approach for molecular dynamics and density-functional theory.
- Intermolecular And Surface Forces
- Relative energies of surface and defect states: ab initio calculations for the MgO (001) surface
- UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations
Their papers
- The General Utility Lattice Program (GULP) (2003) — 2,097 citations
- The SIESTA method; developments and applicability (2008) — 602 citations
- GULP: Capabilities and prospects (2005) — 193 citations
- Siesta: Recent developments and applications. (2020) — 448 citations
- Pristine carbon nanotubes as non-metal electrocatalysts for oxygen evolution reaction of water splitting (2015) — 144 citations
- Pre-nucleation clusters as solute precursors in crystallisation. (2014) — 707 citations
- Is the Calcite–Water Interface Understood? Direct Comparisons of Molecular Dynamics Simulations with Specular X-ray Reflectivity Data (2013) — 156 citations
- Graphenylene, a unique two-dimensional carbon network with nondelocalized cyclohexatriene units (2013) — 161 citations
- Derivation of an accurate force-field for simulating the growth of calcium carbonate from aqueous solution : a new model for the calcite-water interface (2010) — 249 citations