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| 1 | The ReaxFF reactive force-field: development, applications and future directions显示文摘The reactive force-field(ReaxFF)interatomic potential is a powerful computational tool for exploring,developing and optimizing material properties.Methods based on the principles of quantum mechanics(QM),while offering valuable theoretical guidance at the electronic level,are often too computationally intense for simulations that consider the full dynamic evolution of a system.Alternatively,empirical interatomic potentials that are based on classical principles require significantly fewer computational resources,which enables simulations to better describe dynamic processes over longer timeframes and on larger scales.Such methods,however,typically require a predefined connectivity between atoms,precluding simulations that involve reactive events.The ReaxFF method was developed to help bridge this gap.Approaching the gap from the classical side,ReaxFF casts the empirical interatomic potential within a bond-order formalism,thus implicitly describing chemical bonding without expensive QM calculations.This article provides an overview of the development,application,and future directions of the ReaxFF method. | Thomas P Senftle Sungwook Hong Md Mahbubul Islam Sudhir B Kylasa Yuanxia Zheng Yun Kyung Shin Chad Junkermeier Roman Engel-Herbert Michael J Janik Hasan Metin Aktulga Toon Verstraelen Ananth Grama Adri CT van Duin | 2016 | npj Computational Materials2016，，1： | 22 |
| 2 | Tissue engineered skin sub- stitutes created by laser-assisted bioprinting form skin-like struc- tures in the dorsal skin fold chamber in mice 显示文摘 | Michael S Sorg H Peck CT | 2013 | PLoS One2013，8，57： | 1 |
| 3 | The Effect of Dexmedctomidine on Brain Edema and Neurological Outcomes in Surgical Brain Injury in Rats显示文摘 | Michael Bcnggon Han Chcn Richard Applegate ct al | 2012 | Ancsth Analg2012，，： | 1 |
| 4 | Tissue engineered skin sub- stitutes created by laser-assisted bioprinting form skin-like struc- tures in the dorsal skin fold chamber in mice 显示文摘 | Michael S Sorg H Peck CT | 2013 | PLoS One2013，8，57： | 1 |
| 5 | Effects of intravenous levosimendan on human coronary vasomotor regulation, leftventricular wall stress, and myocardial oxygen uptake显示文摘 | Michaels AD McKeown B Kostal M ct al | 2005 | Circulation2005，111，： | 1 |
| 6 | Causes,Epidemiology,and Risk factors of chronic subdural haematoma显示文摘 | Joseph CT Chen MD Michael L | 2000 | Neurosurg Clin N Am2000，11，3： | 1 |
| 7 | A pho- tovoice documentation of the role of neighborhood physical and social environments in older adults physical activity in two metropolitan areas in North America-显示文摘 | Mahmooda A Chaudhury H Michael YL ct al | 2012 | Social Science / Medicine2012，74，8： | 1 |
| 8 | Paxillin:adapting to change显示文摘 | Michael CB and Turner CT | 2004 | Physiol Rev2004，84，4： | 1 |
| 9 | Airport flltures:To- wards a critique of the aerotropolis model显示文摘 | Michael B Charles Paul Barnes Neal Ryan ct aI | 2007 | Fatures2007，39，9： | 1 |
| 10 | Video plankton recor- der reveals high abundances of colonialradiolaria in surface waters of thecentral North Pacific 显示文摘 | Dennett M R Caron D A Michaels A F ct al | 2002 | Journal of Plankton Research2002，24，： | 1 |
| 11 | Tissue engineered skin sub- stitutes created by laser-assisted bioprinting form skin-like struc- tures in the dorsal skin fold chamber in mice 显示文摘 | Michael S Sorg H Peck CT | 2013 | PLoS One2013，8，57： | 1 |
| 12 | Tis- sue engineered skin substitutes created by laser - assisted bioprinting form skin- like structures in the dorsal skin fold chamber in mice 显示文摘 | Michael S Sorg H Peck CT | 2013 | PLoS One2013，8，57： | 1 |
| 13 | Complete neurologic recovery in an outof-hospital cardiac arrest facilitated by initiation of therapeutic hypothermia in a young athlete with an anomalous right coronary artery显示文摘 | Michael CT Douglas BC | 2014 | Journal of Clinical Anesthesia2014，26，3： | 1 |
| 14 | Induction of pulmonary adenomas in strain:a mice by substituted organohalides显示文摘 | Jeffrey CT Michael B Shlmkln LA | 1979 | Cancer Research1979，，39： | 1 |
| 15 | Organic Matter and Nitrogen Conservation in Manure Compost for Organic Agriculture显示文摘 | MICHAEL RAVIV SHLOMIT MEDINA ARKADY KRASNOVSKY ct al | 2004 | Compost Science & Utilization2004，12，1： | 1 |
| 16 | Complete neurologic recovery in an outof-hospital cardiac arrest facilitated by initiation of therapeutic hypothermia in a young athlete with an anomalous right coronary artery显示文摘 | Michael CT Douglas BC | 2014 | Journal of Clinical Anesthesia2014，26，3： | 1 |
| 17 | Complete neurologic recovery in an out- of-hospital cardiac arrest facilitated by initiation of therapeutic hy- pothermia in a young athlete with an anomalous right coronary ar- tery显示文摘 | Michael CT Douglas BC | 2014 | Journal of Clinical Anesthesia2014，26，3： | 1 |
| 18 | Biosynthesis and functions of melanin in Sporothrix schenckii显示文摘 | RAFAEL R M MICHAEL W ANTONIETA G P ct al | 2000 | Infestion and Immunity2000，68，6： | 1 |
| 19 | Mechanism of Phosgene-induced lung toxicity: role of arachidonate mediators 显示文摘 | Guo YL Kennedy TP Michael JR ct ad | 1990 | J ApplPhysiol1990，69，： | 1 |
| 20 | A Simple Game for the Study of Trust in Distributed Systems显示文摘Trust is an important aspect of the design and analysis of secure distributed systems. It is often used informally to designate those portions of a system that must function correctly in order to achieve the desired outcome. But it is a notoriously diffcult notion to formalize. What are the properties of trust? How is it learned, propagated, and utilized successfully? How can it be modeled? How can a trust model be used to derive protocols that are effcient and reliable when employed in today’s expansive networks? Past work has been concerned with only a few of these issues, without concentrating on the need for a comprehensive approach to trust modeling. In this paper, we take a first step in that direction by studying an artificial community of agents that uses a notion of trust to succeed in a game against nature. The model is simple enough to analyze and simulate, but also rich enough to exhibit phenomena of real life interactive communities. The model requires agents to make decisions. To do well, the agents are informed by knowledge gained from their own past experience as well as from the experience of other agents. Communication among agents allows knowledge to propagate faster through the network, which in turn can allow for a more successful community. We analyze the model from both a theoretical and an experimental point of view. | Biography: Zoe Zoe Diamadi, Michael J. Fischer Department of Computer Science, Yale University, New Haven CT 06520 8285,USA | 2001 | Wuhan University Journal of Natural Sciences2001，6，Z1： | 0 |
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