Computer for Research in Chemistry
{'Code': '03090002', 'Directorate': {'Abbreviation': 'MPS', 'LongName': 'Direct For Mathematical & Physical Scien'}, 'Division': {'Abbreviation': 'CHE', 'LongName': 'Division Of Chemistry'}}
{'SignBlockName': 'George M. Rubottom', 'PO_EMAI': None, 'PO_PHON': None}
The recent successes of theoretical chemistry with improved                     programs and faster computers have generated the need for still                 faster machines.  Experienced users wish to solve larger and                    larger problems of more and more relevance to the experimental                  chemist.  Similarly, experimental chemists, seeing these                        results, are compelled to become new users.  The acquisition of                 state-of-the-art computing equipment is essential to the modern                 chemistry department whose faculty are carrying out frontier                    research.                                                                                                                                                       This award from the Chemistry Shared Instrumentation Program                    will be used to help acquire a research mini-supercomputer.                     The acquisition will enhance research activity in the following                 areas of chemical research:                                                                                                                                     1) Computer-assisted studies of structure-activity and                             structure-property relationships using Adapt                                 2) Molecular dynamics in condensed phases                                       3) Quantum chemistry by random walk                                             4) Molecular dynamics simulations of surface reactions                          5) Molecular dynamics simulations of solvation in polar fluids                  6) Ion beam-solid interactions                                                  7) The structure of apocytochrome b-5 in solution                               8) Cluster dynamics and bonding                                                 9) Predictions of carbon-13 NMR relaxation parameters for                          polysaccharides in solution.
{'FirstName': 'Frederick', 'LastName': 'Lampe', 'PI_MID_INIT': 'W', 'PI_SUFX_NAME': None, 'PI_FULL_NAME': 'Frederick W Lampe', 'EmailAddress': None, 'NSF_ID': '000122385', 'StartDate': '08/01/1988', 'EndDate': None, 'RoleCode': 'Principal Investigator'}
{'Name': 'Pennsylvania State Univ University Park', 'CityName': 'UNIVERSITY PARK', 'ZipCode': '168021503', 'PhoneNumber': '8148651372', 'StreetAddress': '201 OLD MAIN', 'StreetAddress2': None, 'CountryName': 'United States', 'StateName': 'Pennsylvania', 'StateCode': 'PA', 'CONGRESSDISTRICT': '15', 'CONGRESS_DISTRICT_ORG': 'PA15', 'ORG_UEI_NUM': 'NPM2J7MSCF61', 'ORG_LGL_BUS_NAME': 'THE PENNSYLVANIA STATE UNIVERSITY', 'ORG_PRNT_UEI_NUM': None}
{'Name': None, 'CityName': None, 'StateCode': None, 'ZipCode': None, 'StreetAddress': None, 'CountryCode': None, 'CountryName': None, 'StateName': None, 'CountryFlag': None, 'CONGRESSDISTRICT': None, 'CONGRESS_DISTRICT_PERF': '""'}
{'Code': '1938', 'Text': 'Chemical Instrumentation'}
{'url': 'https://www.nsf.gov/awardsearch/download?DownloadFileName=1988&All=true', 'xml': '8807809.xml'}