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Did you mean pc524 |u:www-wales.ch.cam.ac.uk?
1 - 7 of 7 search results for :pc53 24 / |u:www-wales.ch.cam.ac.uk where 0 match all words and 7 match some words.

  1. Results that match 1 of 2 words

  2. Bibliography

    https://www-wales.ch.cam.ac.uk/OPTIM.doc/node67.html
    15 Jun 2024: Next: About this document. Up: OPTIM User Guide Previous:Bibliography. D. J. Wales, Energy Landscapes, Cambridge University Press, Cambridge (2003). 2. A. D. MacKerell, D. Bashford, M. Bellott, R. L. Dunbrack, J. D. Evanseck, M. J. Field, S. Fischer,

  3. The Cambridge Energy Landscape Database

    https://www-wales.ch.cam.ac.uk/CCD.html
    13 Jun 2024: S.; Gallegos, M.; Martin Pendas, A.; Rocha-Rinza, T. Wave Function Analyses of Scandium-Doped Aluminium Clusters, AlnSc (n=1-24), and Their CO2 Fixation Abilities.

  4. LWOTP

    https://www-wales.ch.cam.ac.uk/GMIN.doc/node38.html
    15 Jun 2024: 3 # three sites class 1 site 0.0 -0.528902226860823 0.0 orient 0.0 0.0 0.0 # 0.0, -2/3 sin 7pi/24, 0.0 class 1 site ... 0.608761429008721 0.264451113430412 0.0 orient 0.0 0.0 0.0 # cos 7pi/24, 1/3 sin 7pi/24, 0.0 class 1 site -0.608761429008721

  5. TIP4P

    https://www-wales.ch.cam.ac.uk/GMIN.doc/node39.html
    15 Jun 2024: 0 0.0 0.0 matrix # lj sig eps rep att 1 1 lj 1.0 0.25 2510.4d3 2552.24 # need eps = 1/4 to cancel the 4.0

  6. Energy Landscapes: Frequently Asked Questions Thermodynamics The…

    https://www-wales.ch.cam.ac.uk/FAQ.pdf
    4 May 2024: from the multiplicity of alternative routes mediated by different transition. states [24–26]. ... Rev. E 93,012906 (2016). [24] P. Metzner, C. Schütte and E.

  7. Example data Files

    https://www-wales.ch.cam.ac.uk/GMIN.doc/node42.html
    15 Jun 2024: FREEZE. 21 22 23 24 25 26 27 28 29 30.

  8. Keywords

    https://www-wales.ch.cam.ac.uk/OPTIM.doc/node4.html
    15 Jun 2024: DB epsbb epsab sigmabb sigmaab muD E: calls a finite system of dipolar Lennard-Jones dumbbells [24], where the electric field of strength E can be optionally present.

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