B. J. Alder and T. E. Wainwright. Phase transition for a hard sphere system. Journal of Chemical Physics, 27:1208--1209, 1957. Home/Search Document Not in Database Summary Related Articles Check |
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Nasa/tm-2003-212163 - Computational Materials Modeling (2003) (Correct)
....These approaches can model both bonded and nonbonded forces (e.g. Van der Waals and electrostatic) but cannot explicitly account for bond cleavage. The molecular dynamics (MD) method was first introduced by Alder and Wainwright in the late 1950 s to study the interactions of hard spheres[11], 12] Many important insights concerning the behavior of simple liquids emerged from their studies. The next major advance was in 1964, when Rahman carried out the first simulation by using a realistic potential for liquid argon[13] In the current literature, one routinely finds molecular ....
Alder, B.J. and T.E. Wainwright, Phase Transition for a Hard Sphere System, Journal of Chemical Physics, 1957, 27: p. 1208-1211.
A Test Set for Molecular Dynamics Algorithms - Barth, Leimkuhler, Reich (2002) (Correct)
....of the challenges encountered in molecular modeling. Here we begin by briefly discussing the common (classical) molecular dynamics model and the difficulties such a model presents for simulation. Purely collisional hard sphere systems were the first to be studied by molecular simulation [15], and work has continued in this area, for example extending to hard ellipsoids and to hard sphere systems in soft potentials [16 19] In this preliminary version of the test set, we concern ourselves only with smooth potential models such as the monatomic fluids which were first discussed by ....
B.J. Alder and T.E. Wainwright, Phase transition for a hard sphere system,
Thermodynamic Properties Of Asphaltenes: A Predictive.. - Diallo, Cagin, Faulon, .. (2000) (Correct)
.... ESTIMATION OF THERMODYNAMIC PROPERTIES OF CONDENSED PHASE SYSTEMS FROM ATOMISTIC SIMULATIONS Molecular dynamics (MD) and Monte Carlo (MC) simulations have become the most widely used theoretical methods of investigations of condensed phase systems since their inception in the late 1950 s [48,49]. These two methods represent two alternatives THERMODYNAMIC PROPERTIES OF ASPHALTENES 109 but equivalent approaches to the statistical mechanics of N body systems. The original form of the Monte Carlo method was developed to model an N body system in the canonical (NVT) ensemble. The probability ....
Alder, B.J. and Wainwright, T.E., Phase transition for a hard sphere system. J. Chem. Phys., 27: 1208 (1957).
Practical Parallelization of Molecular Dynamics on.. - Kuba, Brunet.. (1997) (1 citation) (Correct)
....Figure 1: Basic MD algorithm Molecular dynamics (MD) is a computational technique used to study the dynamic property of many particle systems by applying Newton s classical equations of motion. This technique has been used since the advent of general purpose computers. Alder and Wainwright [1] were the pioneers of this field. In 1957, they published a paper using the hard sphere model. Rahman and Stillinger [21] were the first to apply MD in order to investigate the movement of a real molecule, water. Using the MD technique, we can understand the movement of each particle and estimate ....
B. J. Alder and T. E. Wainwright. Phase transition for a hard sphere system. J. chem. Phys., 27:1208--1209, 1957.
Constrained Molecular Dynamics as a Search - And Optimization Tool (2004) (Correct)
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B. J. Alder and T. E. Wainwright. Phase transition for a hard sphere system. Journal of Chemical Physics, 27:1208--1209, 1957.
Mdsimaid: An Automatic Recommender For Optimization Of Fast.. - Ko (2002) (3 citations) (Correct)
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B. J. Alder and T. E. Wainwright. Phase transition for a hard sphere system. J. Chem. Phys., 27, 1957.
Classical Molecular Dynamics and Parallel Computing - Sutmann (2002) (Correct)
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B.J. Alder and T.E. Wainwright. Phase transition for a hard sphere system. J. Chem. Phys., 27:12081209, 1957.
Mte 7(3) 9872 - Microscale Thermophysical Engineering (Correct)
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B. J. Alder and T. E. Wainwright, Phase transition of a hard sphere system, J. Chem. Phys., vol. 27, pp. 1208--1209, 1957.
Packing Densities and Simulated Tempering for Hard .. - Mase.. (2000) (2 citations) (Correct)
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Alder, B. J. and Wainwright, T. E. (1957). Phase transition of a hard sphere system. J. Chem. Phys. 27, 1208--1209.
Packing Densities and Simulated Tempering for Hard .. - Mase, Møller.. (1999) (2 citations) (Correct)
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Alder, B. J. and Wainwright, T. E. (1957). Phase transition of a hard sphere system. J. Chem. Phys. 27, 1208--1209.
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