globaloptimization-ESM.pdf from A global optimization perspective on molecular clusters

M. C. Marques, J.; Pereira, F. B.; Llanio-Trujillo, J. L.; Abreu, P. E.; Albertí, M.; Aguilar, A.; Pirani, F.; Bartolomei, M.

doi:10.6084/m9.figshare.4630087.v1

rsta20160198_si_001.pdf (488.03 kB)

globaloptimization-ESM.pdf from A global optimization perspective on molecular clusters

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posted on 2017-02-08, 14:53 authored by J. M. C. Marques, F. B. Pereira, J. L. Llanio-Trujillo, P. E. Abreu, M. Albertí, A. Aguilar, F. Pirani, M. Bartolomei

Supporting Information includes Figure S1, Figure S2, Figure S3, Table S1, and Cartesian coordinates and energies of all minima

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molecular clusters structure optimization microsolvation evolutionary algorithms abinitio calculations molecular dynamics

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globaloptimization-ESM.pdf from A global optimization perspective on molecular clusters

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