Daniel S. Levine, PhD
Affiliations: | University of California, Berkeley, Berkeley, CA, United States |
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| Mao Y, Levine DS, Loipersberger M, et al. (2020) Probing radical-molecule interactions with a second generation energy decomposition analysis of DFT calculations using absolutely localized molecular orbitals. Physical Chemistry Chemical Physics : Pccp |
| Hait D, Tubman NM, Levine DS, et al. (2019) What levels of coupled cluster theory are appropriate for transition metal systems? A study using near exact quantum chemical values for 3d transition metal binary compounds. Journal of Chemical Theory and Computation |
| Cai IC, Ziegler MS, Bunting PC, et al. (2019) Monomeric, Divalent Vanadium Bis(arylamido) Complexes: Linkage Isomerism and Reactivity Organometallics. 38: 1648-1663 |
| Ziegler MS, Torquato NA, Levine DS, et al. (2018) Dicopper Alkyl Complexes: Synthesis, Structure, and Unexpected Persistence Organometallics. 37: 2807-2823 |
| Levine DS, Head-Gordon M. (2017) Energy decomposition analysis of single bonds within Kohn-Sham density functional theory. Proceedings of the National Academy of Sciences of the United States of America |
| Nguyen AI, Wang J, Levine DS, et al. (2017) Synthetic control and empirical prediction of redox potentials for Co4O4 cubanes over a 1.4 V range: implications for catalyst design and evaluation of high-valent intermediates in water oxidation. Chemical Science. 8: 4274-4284 |
| Levine DS, Tilley TD, Andersen RA. (2017) Efficient and selective catalysis for hydrogenation and hydrosilation of alkenes and alkynes with PNP complexes of scandium and yttrium. Chemical Communications (Cambridge, England) |
| Levine DS, Head-Gordon M. (2017) Quantifying the Role of Orbital Contraction in Chemical Bonding. The Journal of Physical Chemistry Letters. 1967-1972 |
| Nguyen AI, Suess DL, Darago LE, et al. (2017) Manganese-Cobalt Oxido Cubanes Relevant to Manganese-Doped Water Oxidation Catalysts. Journal of the American Chemical Society |
| Levine DS, Horn PR, Mao Y, et al. (2016) Variational Energy Decomposition Analysis of Chemical Bonding I: Spin-Pure Analysis of Single Bonds. Journal of Chemical Theory and Computation |