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1 - 10 of 64 search results for TALK:PC53 20 |u:www-wales.ch.cam.ac.uk where 0 match all words and 64 match some words.

  1. Results that match 1 of 2 words

  2. Grphite-water.html

    https://www-wales.ch.cam.ac.uk/~wales/CCD/WebGraphite-TIP5P/Graphite-water.html
    26 Feb 2018: 16. -742.26898. 17. -788.25354. 18. -841.84250. 19. -890.43685. 20. -944.51919. 21.

  3. Grphite-water.html

    https://www-wales.ch.cam.ac.uk/~wales/CCD/WebGraphite-TIP4P/Graphite-water.html
    26 Feb 2018: 16. -746.17784. 17. -788.69914. 18. -847.05006. 19. -893.67147. 20. -953.95025. 21.

  4. Grphite-water.html

    https://www-wales.ch.cam.ac.uk/~wales/CCD/WebGraphite-TIP3P/Graphite-water.html
    26 Feb 2018: 16. -728.94259. 17. -776.16235. 18. -830.62715. 19. -881.57840. 20. -935.99549. 21.

  5. Minimos para el Ca

    https://www-wales.ch.cam.ac.uk/~wales/CCD/water_cation/Li/Minimos_para_el_Li.html
    26 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.

  6. Minimos para el Ca

    https://www-wales.ch.cam.ac.uk/~wales/CCD/water_cation/Ca/Minimos_para_el_Ca.html
    26 Feb 2018: Ca. 2+. (H. 2. O). n. , n=1-20. Clusters. 1. N. ... 15. -1570.655233. 16. -1632.206347. 17. -1692.889462. 18. -1752.908213. 19. -1810.314062. 20.

  7. Minimos para el water-c60

    https://www-wales.ch.cam.ac.uk/~wales/CCD/water-C60/Minimos_water_fuller.html
    26 Feb 2018: 751.2771. 18. -804.8519. 19. -852.0514. 20. -904.8941. 21. -947.5069. All figures were produced with XCrySDen.

  8. The Cambridge Energy Landscape Database

    https://www-wales.ch.cam.ac.uk/~wales/CCD/TIP5P_ccd_page/TIP5P.html
    26 Feb 2018: 17. -729.4807 kJ/mol. 18. -780.3213 kJ/mol. 19. -833.3290 kJ/mol. 20. -881.3449 kJ/mol.

  9. Global minima for the Thomson problem

    https://www-wales.ch.cam.ac.uk/~wales/CCD/Thomson/table.html
    26 Feb 2018: 106.0504048. 18. 120.0844674. 19. 135.0894675. 20. 150.8815683. h. 21. 167.6416223. 22.

  10. The Cambridge Energy Landscape Database

    https://www-wales.ch.cam.ac.uk/~wales/CCD/Ne+.html
    26 Feb 2018: 19. -0.0775878 hartree. 20. -0.0783943 hartree. 21. -0.0793729 hartree. 22. -0.0800062 hartree.

  11. Global minima of protonated water clusters

    https://www-wales.ch.cam.ac.uk/~wales/CCD/H3O+..H2ON/gmin.html
    26 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

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