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检索条件"机构=The Program of Applied and Computational Mathematics"
1029 条 记 录,以下是771-780 订阅
排序:
Origin of the Energy Barrier to Chemical Reactions of O2 on Al(111): Evidence for Charge Transfer, Not Spin Selection
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Physical Review Letters 2012年 第19期109卷 198303-198303页
作者: Florian Libisch Chen Huang Peilin Liao Michele Pavone Emily A. Carter Departments of Mechanical and Aerospace Engineering and Chemistry Program in Applied and Computational Mathematics and Andlinger Center for Energy and the Environment Princeton University Princeton New Jersey 08544 USA Theoretical Division Los Alamos National Laboratory New Mexico 87544 USA
Dissociative adsorption of molecular oxygen on the Al(111) surface exhibits mechanistic complexity that remains surprisingly poorly understood in terms of the underlying physics. Experiments clearly indicate substanti... 详细信息
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Multilayer thin film growth on crystalline and quasicrystalline surfaces: A phase-field crystal study
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Physical Review B 2012年 第24期85卷 245428-245428页
作者: Srevatsan Muralidharan Raika Khodadad Ethan Sullivan Mikko Haataja Department of Mechanical and Aerospace Engineering Princeton Institute for the Science and Technology of Materials (PRISM) Program in Applied and Computational Mathematics (PACM) Princeton University Princeton New Jersey 08544 USA and School of Mathematics Institute for Advanced Study Princeton New Jersey 08540 USA
In this paper, we explore the effects of misfit strain fields on both heterogeneous nucleation behavior and anisotropic growth of islands at submonolayer coverages and compositional patterning at complete monolayer co... 详细信息
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Spectral Dynamics of Spatially Incoherent Modulation Instability
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Physical Review Letters 2012年 第26期108卷 263902-263902页
作者: Can Sun Laura Waller Dmitry V. Dylov Jason W. Fleischer Department of Electrical Engineering Princeton University Princeton New Jersey 08544 USA General Electric Global Research Center Niskayuna New York 12309 USA Program in Applied and Computational Mathematics Princeton University Princeton New Jersey 08544 USA
To date, all experiments in nonlinear statistical optics have relied on beams whose transverse spatial statistics were Gaussian. Here, we present a new technique to generalize these studies by using a spatial light mo... 详细信息
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Density-decomposed orbital-free density functional theory for covalently bonded molecules and materials
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Physical Review B 2012年 第23期86卷 235109-235109页
作者: Junchao Xia Emily A. Carter Department of Mechanical and Aerospace Engineering Princeton University Princeton New Jersey 08544-5263 USA Program in Applied and Computational Mathematics and Andlinger Center for Energy and the Environment Princeton University Princeton New Jersey 08544-5263 USA
We propose a density decomposition scheme using a Wang-Govind-Carter- (WGC-) based kinetic energy density functional (KEDF) to accurately and efficiently simulate various covalently bonded molecules and materials with... 详细信息
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Density of States for a Specified Correlation Function and the Energy Landscape
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Physical Review Letters 2012年 第8期108卷 080601-080601页
作者: C. J. Gommes Y. Jiao S. Torquato Department of Chemical Engineering University of Liège B-4000 Liège Belgium Department of Chemistry Princeton University Princeton New Jersey 08544 USA Program in Applied and Computational Mathematics and Princeton Center for Theoretical Science Princeton University Princeton New Jersey 08544 USA
The degeneracy of two-phase disordered microstructures consistent with a specified correlation function is analyzed by mapping it to a ground-state degeneracy. We determine for the first time the associated density of... 详细信息
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Singularities of quantum control landscapes
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Physical Review A 2012年 第1期86卷 013405-013405页
作者: Re-Bing Wu Ruixing Long Jason Dominy Tak-San Ho Herschel Rabitz Department of Automation Tsinghua University Beijing 100084 China and Center for Quantum Information Science and Technology TNList Beijing 100084 China Department of Chemistry Princeton University Princeton New Jersey 08544 USA Program in Applied and Computational Mathematics Princeton University Princeton New Jersey 08544 USA
Quantum control landscape theory was formulated to assess the ease of finding optimal control fields in simulations and in the laboratory. The landscape is the observable as a function of the controls, and a primary g... 详细信息
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Importance of reference Hamiltonians containing exact exchange for accurate one-shot GW calculations of Cu2O
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Physical Review B 2012年 第23期85卷 235142-235142页
作者: Leah Y. Isseroff Emily A. Carter Department of Chemical and Biological Engineering Princeton University Princeton New Jersey 08544-5263 USA Department of Mechanical and Aerospace Engineering Program in Applied and Computational Mathematics and Andlinger Center for Energy and the Environment Princeton University Princeton New Jersey 08544-5263 USA
We show that a “one-shot” GW approach (denoted G0W0) can accurately calculate the photoemission/inverse-photoemission properties of Cu2O. As the results of any perturbative method are heavily dependent on the refere...
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Efficient coarse simulation of a growing avascular tumor
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Physical Review E 2012年 第3期85卷 031912-031912页
作者: Michail E. Kavousanakis Ping Liu Andreas G. Boudouvis John Lowengrub Ioannis G. Kevrekidis School of Chemical Engineering National Technical University of Athens 9 Heroon Polytechniou St. Zographos Athens GR-15780 Greece Department of Chemical and Biological Engineering Princeton University Princeton New Jersey 08544 USA Department of Mathematics University of California 103 MSTB Irvine California 92697 USA Program in Applied and Computational Mathematics Princeton University Princeton New Jersey 08544 USA
The subject of this work is the development and implementation of algorithms which accelerate the simulation of early stage tumor growth models. Among the different computational approaches used for the simulation of ... 详细信息
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Model reduction for agent-based social simulation: Coarse-graining a civil violence model
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Physical Review E 2012年 第6期85卷 066106-066106页
作者: Yu Zou Vladimir A. Fonoberov Maria Fonoberova Igor Mezic Ioannis G. Kevrekidis Department of Chemical and Biological Engineering and Program in Applied and Computational Mathematics Princeton University Princeton New Jersey 08544 USA Aimdyn Inc. 1919 State Street Suite 207 Santa Barbara California 93101 USA Department of Mechanical Engineering University of California Santa Barbara Santa Barbara California 93106 USA
Agent-based modeling (ABM) constitutes a powerful computational tool for the exploration of phenomena involving emergent dynamic behavior in the social sciences. This paper demonstrates a computer-assisted approach th... 详细信息
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Seismic Probes of Solar Interior Magnetic Structure
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Physical Review Letters 2012年 第10期109卷 101101-101101页
作者: Shravan Hanasoge Aaron Birch Laurent Gizon Jeroen Tromp Department of Geosciences Princeton University New Jersey 08544 USA Max-Planck Institut für Sonnensystemforschung 37191 Kalenburg-Lindau Germany Georg-August-Universität Institut für Astrophysik D-37077 Göttingen Germany Program for Applied and Computational Mathematics Princeton University New Jersey 08544 USA
Sun spots are prominent manifestations of solar magnetoconvection, and imaging their subsurface structure is an outstanding problem of wide physical importance. Travel times of seismic waves that propagate through the... 详细信息
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