Acquisition of Bruker AC-80 NMR with MacSpect 3 MNMR System

使用 MacSpect 3 MNMR 系统获取 Bruker AC-80 NMR

• 批准号: 9512329
• 负责人: Michael De Rosa
• 金额: $ 7.29万
• 依托单位: Pennsylvania State Univ University Park
• 依托单位国家: 美国
• 项目类别: Standard Grant
• 财政年份: 1995
• 资助国家: 美国
• 起止时间: 1995-09-01 至 1997-02-28
• 项目状态: 已结题
• 来源: https://www.nsf.gov/awardsearch/showAward?AWD_ID=9512329&HistoricalAwards=false
• 关键词: Acquisition; Bruker; AC; 80; NMR

This award from the Academic Research Infrastructure Program will help the Department of Chemistry at University of Mississippi acquire a SGI Power Challenge L with four R8000 processors and 128MB of memory. The research activity to be supported includes high level ab initio and density functional calculations on a variety of molecules and reaction surfaces and rotational spectral modeling and fitting of weakly bound molecules. A workstation network of fast, modern computer workstations is a new way to satisfy the computing needs of chemistry departments. Such a "computer network" also serves as a development environment for new theoretical codes and algorithms, provides state-of-the-art graphics and visualization facilities.

这份来自学术研究基础设施项目的合同将帮助密西西比大学化学系获得SGI Power Challenge L型计算机，该计算机拥有4个R8000处理器和128MB内存。支持的研究活动包括对各种分子和反应表面的高水平从头算和密度泛函计算，以及弱结合分子的旋转光谱建模和拟合。快速、现代化的计算机工作站网络是满足化学部门计算需求的新途径。这样的“计算机网络”也可以作为新的理论代码和算法的开发环境，提供最先进的图形和可视化设施。