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Global Minima of Cobalt Nanoclusters
https://www-wales.ch.cam.ac.uk/~wales/CCD/CoCCD/cobalt.html26 Feb 2018: Cobalt Nanoclusters: Table of Global Minima obtained using Gupta potential. Global minima for Cobalt nanoclusters (2-200) interacting with the Gupta potential. For each minimum the energy and point group are given. The unit of energy is eV. Click on -
Global Minima of Molybdenum Nanoclusters
https://www-wales.ch.cam.ac.uk/~wales/CCD/FS_Mo/moly_fs.html26 Feb 2018: Molybdenum Nanoclusters: Table of Global Minima obtained using Finnis-Sinclair potential. Global minima for Molybdenum nanoclusters (3-100 atoms) interacting with the Finnis-Sinclair potential [1]. [1] Finnis, M.W. and Sinclair, J.E. Phil. Mag. A 50 -
Global Minima of Iron Nanoclusters
https://www-wales.ch.cam.ac.uk/~wales/CCD/FS_Fe/iron_fs.html26 Feb 2018: Iron Nanoclusters: Table of Global Minima obtained using Finnis-Sinclair potential. Global minima for iron nanoclusters (3-100 atoms) interacting with the Finnis-Sinclair potential [1] (using modified parameters in [2]). [1] Finnis, M.W. and Sinclair -
Global minima of protonated water clusters
https://www-wales.ch.cam.ac.uk/~wales/CCD/H3O+..H2ON/gmin.html26 Feb 2018: The Cambridge Cluster Database. Global Minima of Protonated Water Clusters. Matthew P. Hodges and David J. Wales. Chemical Physics Letters, 324, 279-288, 2000. Notes:. The XYZ files contain the Cartesian coordinates of the tightly optimized minima -
Grphite-water.html
https://www-wales.ch.cam.ac.uk/~wales/CCD/WebGraphite-TIP5P/Graphite-water.html26 Feb 2018: 16. -742.26898. 17. -788.25354. 18. -841.84250. 19. -890.43685. 20. -944.51919. 21. -
dscn0017
https://www-wales.ch.cam.ac.uk/Telluride/David/4-Cornet_Creek.28.7.05/dscn0017-r.html26 Feb 2018: 2005-06-28 04:42. [Image 20 of 37. [reduced]. (79k). [large]. (312k). [original]. -
Minimos para el water-c60
https://www-wales.ch.cam.ac.uk/~wales/CCD/water-C60/Minimos_water_fuller.html26 Feb 2018: 751.2771. 18. -804.8519. 19. -852.0514. 20. -904.8941. 21. -947.5069. All figures were produced with XCrySDen. -
dscn0173
https://www-wales.ch.cam.ac.uk/Telluride/David/7-Ingram_Lake.4.8.05/dscn0173-l.html26 Feb 2018: 2005-07-04 07:20. [Image 26 of 32. [reduced]. (99k). [large]. (352k). [original]. -
Minimos para el Ca
https://www-wales.ch.cam.ac.uk/~wales/CCD/water_cation/Li/Minimos_para_el_Li.html26 Feb 2018: Li. (H. 2. O). n. , n=1-20 Clusters. 1. N. Energy [kJ/mol]. ... 16. -1067.197045. 17. -1117.060492. 18. -1169.571177. 19. -1222.607755. 20. -1270.888181. All figures were produced with XCrySDen. -
dscn0127
https://www-wales.ch.cam.ac.uk/Telluride/David/6-Imogene.31.7.05/dscn0127-l.html26 Feb 2018: 2005-07-01 03:36. [Image 20 of 38. [reduced]. (54k). [large]. (200k). [original].
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