神经网络全局势函数在多相催化中的应用

当今的多相催化研究需要新的技术和方法从原子尺度上表征活性中心结构和反应中间体。本文作者课题组近期开发了理论模拟新技术来探索催化剂活性位点结构，即基于神经网络势函数的大规模原子模拟（LASP）软件中实现的全局神经网络势函数计算方法。本文介绍了该方法可以显著降低催化体系的计算代价，而维持与密度泛函理论同一级别的计算精度，从而解决多相催化中的许多复杂问题。本文对神经网络势函数方法的实现细节和目前已实现的应用场景进行了详细介绍。神经网络势函数可以用来预测材料晶体结构，理解高压氢化条件下TiO₂表面的结构演化和确定三元氧化物ZnCrO晶相中合成气制甲醇活性位点。最后文章分析了神经网络势函数的局限性和今后可能的三个研究方向，即材料性质预测、多元素体系神经网络势函数构造和化学反应拟合。     

Recognition of occupational therapy exercises and detection of compensation mistakes for Cerebral Palsy

Depth camera-based virtual rehabilitation systems are gaining attention in occupational therapy for cerebral palsy patients. When developing such a system, domain-specific exercise recognition is vital. To design such a gesture recognition method, some obstacles need to be overcome: detection of gestures not related to the defined exercise set and recognition of incorrect exercises performed by the patients to compensate for their lack of ability. We propose a framework based on hidden Markov models for the recognition of upper extremity functional exercises. We determine critical compensation mistakes together with restrictions for classifying these mistakes with the help of occupational therapists. We first eliminate undefined gestures by evaluating two models that produce adaptive threshold values. Then we utilize specific negative models based on feature thresholding and train them for each exercise to detect compensation mistakes. We perform various tests using our method in a laboratory environment under the supervision of occupational therapists.     

考虑行走弹性影响下的车辆换挡过程分析

为研究行走弹性对工程车辆行走换挡过程的影响，建立了考虑驱动轮轮胎变形引起的车辆行走弹性影响的整车行走动力学模型，该模型适用于换挡过程分析。计算与分析了典型装载机动力换挡过程，将考虑或不考虑行走弹性时计算得到的整车加速度和瞬时冲击度的变化过程分别进行了对比，利用实车试验对单一换挡过程进行了验证；并将考虑行走弹性时升挡过程中变速箱输入输出转速变化过程、离合器滑摩功率特性的计算结果与不考虑行走弹性时换挡过程的计算结果进行了对比。研究结果表明：与不考虑行走弹性的情况相比，行走弹性变形使得换挡过程中整车加速度的变化更加平缓；换入挡离合器有两次滑摩过程，冲击度更小，换挡时间更长；离合器接合时的冲击度与其接入时间有关；滑摩功更小。     

Exploring the biomechanics of walking and crowd “flow”

Crowd movement simulation models are generally based on aggregated speed and flow data collected more than 50 years ago. There appears to be no validated modelling capability to include the impact of recent and future changes in population demographics, resulting from an ageing population and increasing obesity rates. New analytical approaches and data gathering are required to successfully model crowd movement and safety for current and future generations. This study carried out (a) a review of the primary components of crowd movement, demographics and analytical techniques, (b) prototype experiments to investigate age-related aspects of space and potential points of contact and (c) a new predictive model for crowd flow analysis based on pedestrian biomechanics and anthropometric data. The model uses the physical space taken up by the biomechanical walking process and the spatial buffer between points of potential contact with other pedestrians to predict the speed of movement at different levels of congestion. The new analytical model was used to predict single file speeds (for people with different demographics in congested space), which compared well with published experimental data. The next steps for model development for wider “flows” and additional experiments to provide data sets for wider demographics are also proposed.     

基于康复训练中力信号的人体参与度建模

设计一种基于人机接触力的人体主动参与程度评估模型,用于康复机器人应用中的主动康复训练。通过人体的肌电信号得到肌肉活跃度,确定肌电信号与人体参与度的关系。分析这一过程中人机接触力的变化,将腿部力信号平均值以及腰部力信号方差作为模型输入,对基于肌电信号的参与度模型进行拟合,得到基于力信号的参与度模型,使用肌电信号参与度模型对力信号参与度模型进行验证,证明了该模型的有效性。该方法避免了肌电信号采集时干扰较大且准备工作繁琐等缺点,具有良好的实用性。     

Boccia game simulator: Serious game adapted for people with disabilities

Integration in the world of sport is one way for individuals with disabilities or motor disorders to feel more socially integrated, independent, and confident. Boccia is a Paralympic sport, which is increasingly getting more attention around the world. These facts have contributed to the objectives of this work. Including it in the serious games category enables to develop and rehabilitate the cognitive capabilities. The main focus was BC3 classification athletes (users with limited motor characteristics that require the use of an assistive device—a ramp, in this case). This paper describes a realistic Boccia game simulator adapted for people with disabilities that integrates a set of features that includes real physics and social features. These features can be used to enhance the interest of nonpractitioners of the sport and to improve the training conditions. The official Boccia regulation was added to the design of the simulator. The usability and approximation to the reality of the simulator were tested and validated based on the tests performed and data collected via a survey of users with no motor or psychological disorders. Realism and usability rating was almost excellent, and good results were achieved at the assessment of the game experience.     

一种家用手持式红外偏振光治疗仪的设计与实现

红外偏振光治疗仪是一种将红外技术与电子技术应用到医学领域的康复理疗设备,主要用于软组织损伤和慢性疼痛的康复治疗,已在医院得到了推广使用。然而,现有医院使用的台式治疗仪由于体积大、售价高等特点,不方便居家使用。为了开发体积小、售价低、家庭可用的红外偏振光治疗仪,满足家用市场的潜在需求,本文提出了一种新的便携手持式红外偏振光治疗仪,并开发了该智能控制系统。本文首先介绍了一种新的家用手持式治疗仪应具备的特点和关键技术指标,在此基础上设计了手持式治疗仪的硬件总体方案和软件架构,简要介绍了该治疗仪的一些关键技术,最终实现了治疗仪样机的研制。为了验证该样机的性能,本文通过大量的测试,结果表明,研制的手持式红外偏振光治疗仪在关键参数指标上达到了医院同类产品的水平,能够很好地满足家用的需求,具有良好的市场前景。     

Die Baugesellschaft Gebrüder Rank und ihre spanischen Ziegelgewölbe in München

The Rank construction company and the introduction of brick vaults in Munich after 1945 The construction of vaults without scaffolding with thin bricks has a centuries‐old tradition, particularly in Spain and Italy. Since the beginning of the 19^th century, it has been successfully spread mainly on the American double continent. The Rank Brothers construction company in Munich is known to date as one of those construction companies that began building with concrete in its home city very early on. New investigations, which were made possible above all by the provision of archive material by Paul Basiner, now point to an additional focus of this company's work. The architects and engineers of the company had been also able to familiarise themselves with this traditional Spanish brick‐vaulted construction method via the branch office in Spain, which was established from 1911 on. This knowledge was particularly in demand in the years following World War II, when the destroyed vaults had to be rebuilt with simple means and low material consumption. Together with Carl Sattler, who had become acquainted with similar construction methods in Italy, brick vaults were initially used to complete the construction of the Landeszentralbank in Munich. In the following years, Rank was able to provide many buildings in and around Munich with brick vaults. It was not until the 1960s that this construction technique went out of fashion and was thus somewhat forgotten.     

土地整理项目后评价初探

随着各级土地整理、复垦项目的完成,土地整理、复垦项目的后评价逐渐浮出水面,简单验收完成后,对土地整理、复垦项目长期的、可持续性的、环境影响大小的、产权归属调整的各项问题逐步显现出来,这就提出了利用科学的发展观对土地整理、复垦项目进行后评价的要求,经过后评价才能科学地认识土地整理、复垦项目对社会的综合影响力,其现实意义和历史意义才会有定性的地位。