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Date of download: 1/22/2018 Copyright © ASME. All rights reserved. From: Modification of Nóse–Hoover Thermostat to Improve Temperature Response in Molecular Simulations J. Comput. Nonlinear Dynam. 2017;12(3): doi: / Figure Legend: Time evolution of system. Cations (small) and anions (medium) are shown here interacting with a silicon dioxide nanoparticle (large). Ionic radii are enlarged for viewing.
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Date of download: 1/22/2018 Copyright © ASME. All rights reserved. From: Modification of Nóse–Hoover Thermostat to Improve Temperature Response in Molecular Simulations J. Comput. Nonlinear Dynam. 2017;12(3): doi: / Figure Legend: System energy and thermostat work. (a) Standard thermostat, (b) modified thermostat, and (c) comparison of total system energy from (a) and (b).
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Date of download: 1/22/2018 Copyright © ASME. All rights reserved. From: Modification of Nóse–Hoover Thermostat to Improve Temperature Response in Molecular Simulations J. Comput. Nonlinear Dynam. 2017;12(3): doi: / Figure Legend: Effect of varying gains on simulation time
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Date of download: 1/22/2018 Copyright © ASME. All rights reserved. From: Modification of Nóse–Hoover Thermostat to Improve Temperature Response in Molecular Simulations J. Comput. Nonlinear Dynam. 2017;12(3): doi: / Figure Legend: Temperature response using standard thermostat for fixed and stepped target temperatures. Brownian motion disabled.
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Date of download: 1/22/2018 Copyright © ASME. All rights reserved. From: Modification of Nóse–Hoover Thermostat to Improve Temperature Response in Molecular Simulations J. Comput. Nonlinear Dynam. 2017;12(3): doi: / Figure Legend: Temperature response using modified thermostat for fixed and stepped target temperatures. Brownian motion disabled.
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Date of download: 1/22/2018 Copyright © ASME. All rights reserved. From: Modification of Nóse–Hoover Thermostat to Improve Temperature Response in Molecular Simulations J. Comput. Nonlinear Dynam. 2017;12(3): doi: / Figure Legend: Brownian motion enabled
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Date of download: 1/22/2018 Copyright © ASME. All rights reserved. From: Modification of Nóse–Hoover Thermostat to Improve Temperature Response in Molecular Simulations J. Comput. Nonlinear Dynam. 2017;12(3): doi: / Figure Legend: Brownian motion enabled
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Date of download: 1/22/2018 Copyright © ASME. All rights reserved. From: Modification of Nóse–Hoover Thermostat to Improve Temperature Response in Molecular Simulations J. Comput. Nonlinear Dynam. 2017;12(3): doi: / Figure Legend: Effect of varying gains on response. (a) O(Q) = 1, (b) O(Q) = 10, (c) O(Q) = 100, and (d) O(Q) = 1000. The inset shows the order of the derivative gain.
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Date of download: 1/22/2018 Copyright © ASME. All rights reserved. From: Modification of Nóse–Hoover Thermostat to Improve Temperature Response in Molecular Simulations J. Comput. Nonlinear Dynam. 2017;12(3): doi: / Figure Legend: Mechanical model: sodium, potassium, and nitrate ions represented by spherical particles
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