Concepedia

Prediction of crystal structures from crystal chemistry rules by simulated annealing

J. Pannetier, J. Bassas-Alsina, J. Rodrı́guez-Carvajal, V. Caignaert

Nature · 1990 · 270 citations · 11 references

DOI

Concepts

References

11

Optimization by Simulated Annealing

Scott Kirkpatrick, C. D. Gelatt, M.P. Vecchi · Science · 1983 · 44.6K citations

, , +10

Equation of State Calculations by Fast Computing Machines

N. Metropolis, Arianna W. Rosenbluth, M. N. Rosenbluth et al. · The Journal of Chemical Physics · 1953 · 37.1K citations

, , +9

THE PRINCIPLES DETERMINING THE STRUCTURE OF COMPLEX IONIC CRYSTALS

Linus Pauling · Journal of the American Chemical Society · 1929 · 2K citations

, , +14

Crystals from first principles

John Maddox · Nature · 1988 · 461 citations · Full text

, , +12

A new route to charge distributions in ionic solids

Rudolf Hoppe, Stephan Voigt, H. Glaum et al. · Journal of the Less Common Metals · 1989 · 376 citations

, , +14