Electronic and Geometrical Structures of Molecules
{'Code': '03090004', 'Directorate': {'Abbreviation': 'MPS', 'LongName': 'Direct For Mathematical & Physical Scien'}, 'Division': {'Abbreviation': 'CHE', 'LongName': 'Division Of Chemistry'}}
{'SignBlockName': 'James E. Boggs', 'PO_EMAI': None, 'PO_PHON': None}
In this project in the Theoretical and Computational Physical                   Chemistry Program of the Chemistry Division, Prof. Lipscomb                     will carry out studies of geometrical and electronic structures                 of molecules with objectives of obtaining information about the                 stable states and the transition states of chemical reactions.                                                                                                  Studies of boranes and their derivatives, including the                         condensation of diborane to form the higher hydrides of boron,                  will require extensive corrections for correlation of electrons                 in searching for transition states.  Theoretical studies of                     enzyme mechanisms are aimed at elucidation of entropy effects,                  binding of the transition state, catalytic steps, solvent                       effects, enzyme environment and dynamical effects to establish                  principles for construction of artificial enzymes as catalysts.
{'FirstName': 'William', 'LastName': 'Lipscomb', 'PI_MID_INIT': 'N', 'PI_SUFX_NAME': None, 'PI_FULL_NAME': 'William N Lipscomb', 'EmailAddress': 'lipscomb@chemistry.edu', 'NSF_ID': '000342729', 'StartDate': '04/15/1989', 'EndDate': None, 'RoleCode': 'Principal Investigator'}
{'Name': 'Harvard University', 'CityName': 'CAMBRIDGE', 'ZipCode': '021385366', 'PhoneNumber': '6174955501', 'StreetAddress': '1033 MASSACHUSETTS AVE STE 3', 'StreetAddress2': None, 'CountryName': 'United States', 'StateName': 'Massachusetts', 'StateCode': 'MA', 'CONGRESSDISTRICT': '05', 'CONGRESS_DISTRICT_ORG': 'MA05', 'ORG_UEI_NUM': 'LN53LCFJFL45', 'ORG_LGL_BUS_NAME': 'PRESIDENT AND FELLOWS OF HARVARD COLLEGE', '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': '1954', 'Text': 'QUANTUM CALCULATIONS'}
{'url': 'https://www.nsf.gov/awardsearch/download?DownloadFileName=1988&All=true', 'xml': '8820590.xml'}