Uranyl Carbonate Complexes in Aqueous Solution and Their Ligand NMR Chemical Shifts and 17 O Quadrupolar Relaxation Studied by ab Initio Molecular Dynamics
Journal Article
·
· Inorganic Chemistry
Not provided.
- Research Organization:
- Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Oak Ridge Leadership Computing Facility (OLCF); State Univ. of New York (SUNY), Albany, NY (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC)
- DOE Contract Number:
- SC0001136
- OSTI ID:
- 1534536
- Journal Information:
- Inorganic Chemistry, Vol. 56, Issue 13; ISSN 0020-1669
- Publisher:
- American Chemical Society (ACS)
- Country of Publication:
- United States
- Language:
- English
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