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on multiple scales, ranging from continuum and empirical molecular mechanics models to first-principles quantum chemistry, often fall short for complementary reasons: the various intermolecular interactions
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-Dirac statistics forbid multiple occupation of any quantum state. As part of the Joint Quantum Institute our group collaborates with experimentalists and theorists at NIST, the University of Maryland
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[Suiter et al., 2020]. This type of novel NMR-based measurement has the potential to overcome the limitations of conventional VLE measurements, but multiple engineering problems stand in the way
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