Gas Phase Study of Solution Phase Species and Chemistry Using Variable Temperature Photoelectron Spectrometer
EMSL Project ID
50593
Abstract
We propose to investigate solution phase species and chemistry in the gas phase using a recently developed low-temperature photoelectron spectrometer. The subjects include but not limited to, temperature-dependent studies on solvation of complex anions, electronic strcuctures of environmentally important diradical species, and dissolution of salts at solution and interfaces.
Project Details
Start Date
2018-10-26
End Date
2019-09-30
Status
Closed
Released Data Link
Team
Principal Investigator
Team Members
Related Publications
Apra E., J. Warneke, S.S. Xantheas, and X. Wang. 2019. "A benchmark photoelectron spectroscopic and theoretical study of the electronic stability of [B12H12]2-." Journal of Chemical Physics 105, no. 16:164306. PNNL-SA-140650. doi:10.1063/1.5089510
Castro K.P., E.V. Bukovsky, I.V. Kuvychko, N.J. DeWeerd, Y. Chen, S. Deng, and X. Wang, et al. 2019. "PAH/PAH(CF3)n Donor/Acceptor Charge-Transfer Complexes in Solution and in Solid-State Co-Crystals." Chemistry - A European Journal 25, no. 59:13547-13565. PNNL-SA-145003. doi:10.1002/chem.201902712
Hou G., and X. Wang. 2019. "Spectroscopic Signature of Proton Location in Proton Bound HSO4–·H+·X– (X = F, Cl, Br, and I) Clusters." The Journal of Physical Chemistry Letters 10, no. 21:6714-6719. PNNL-SA-145375. doi:10.1021/acs.jpclett.9b02663
Hou G., M. Valiev, and X. Wang. 2019. "Sulfuric acid and aromatic carboxylate clusters H2SO4•ArCOO-: structures, properties, and their relevance to the initial aerosol nucleation." International Journal of Mass Spectrometry 439. PNNL-SA-140519. doi:10.1016/j.ijms.2019.02.001
Li Z., Z. Hu, Y. Jiang, Q. Yuan, H. Sun, X. Wang, and Z. Sun. 2019. "Electronic structures and binding motifs of sodium polysulfide clusters NaSn- (n = 5-9): a joint negative ion photoelectron spectroscopy and computational investigation." Journal of Chemical Physics 150, no. 24:Article number 244305. PNNL-SA-142853. doi:10.1063/1.5100733
Mayer M., V. Van Lessen, M. Rohdenburg, G. Hou, Z. Yang, R.M. Exner, and E. Apra, et al. 2019. "Rational design of an argon-binding superelectrophilic anion." Proceedings of the National Academy of Sciences of the United States of America 116, no. 17:8167–8172. PNNL-SA-140803. doi:10.1073/pnas.1820812116
Warneke J., M. Rohdenburg, J.K. Liu, E. Johnson, X. Ma, R. Kumar, and P. Su, et al. 2019. "Gas Phase Fragmentation of Adducts Between Dioxygen and closo-Borate Radical Anions." International Journal of Mass Spectrometry 436. PNNL-SA-136763. doi:10.1016/j.ijms.2018.11.005
Warneke J., S.Z. Konieczka, G. Hou, E. Apra, C. Kerpen, F. Keppner, and T.C. Schaefer, et al. 2019. "Properties of perhalogenated {closo-B10} and {closo-B11} multiply charged anions and a critical comparison with {closo-B12} in the gas and the condensed phase." Physical Chemistry Chemical Physics 21, no. 11:5903-5915. PNNL-SA-135487. doi:10.1039/C8CP05313H
Yang Z., D. Hrovat, G. Hou, W. Borden, and X. Wang. 2019. "Negative Ion Photoelectron Spectroscopy Confirms the Prediction of a Singlet Ground State for the 1,8-Naphthoquinone Diradical." Journal of Physical Chemistry A 123, no. 14:3142-3148. PNNL-SA-139614. doi:10.1021/acs.jpca.8b11063
Yuan Q., X. Kong, G. Hou, L. Jiang, and X. Wang. 2019. "Electrospray ionization photoelectron spectroscopy of cryogenic [EDTA•M(II)]2- complexes (M = Ca, V-Zn): electronic structures and intrinsic redox properties." Faraday Discussions 217. PNNL-SA-139578. doi:10.1039/c8fd00175h