Concepedia
Journal of Molecular Structure · 2015 · 14 citations · 29 references
New Tetranuclear CopperChemical EngineeringStructural CharacterizationEngineeringCoordination ComplexOrganic ChemistryChemistryInorganic Compound
29
Density-functional thermochemistry. III. The role of exact exchange
Axel D. Becke · The Journal of Chemical Physics · 1993 · 101.1K citations
Electron Density, Chemical Thermodynamics, Engineering +13
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 98.6K citations
Electron Density, Gradient Expansions, Engineering +14
A short history of<i>SHELX</i>
George M. Sheldrick · Acta Crystallographica Section A Foundations of Crystallography · 2007 · 86.8K citations · Full text
Shelx System, Engineering, Molecular Biology +14
General atomic and molecular electronic structure system
Michael W. Schmidt, Kim K. Baldridge, Jerry A. Boatz et al. · Journal of Computational Chemistry · 1993 · 20.1K citations
Parallel Calculations, Engineering, Detailed Speecup Results +18
van der Waals Volumes and Radii
A. Bondì · The Journal of Physical Chemistry · 1964 · 19K citations
Altmetrics, Physics, Donut Icon +10