Publications 研究業績

  1. “Electrochemical Tuning-Induced Magnetic Transitions in Geometrically Frustrated Spinel LixMn2O4 (0.07 ≤ x ≤ 0.93)”
    Q. Chen, Z. Zhang,* K. Awaga*
    J. Phys. Chem. C 2021, In press.
    DOI: 10.1021/acs.jpcc.1c00291
  2. “Enhanced proton conductivity in a flexible metal–organic framework promoted by single-crystal-to-single-crystal transformation”
    X. Chen, Z. Zhang,* J. Chen, S. Sapchenko, X. Han, I. da-Silva, M. Li, I. J. Vitorica-Yrezabal, G. Whitehead, C. C. Tang, K. Awaga, S. Yang,* M. Schröder*
    Chem. Commun. 2021, 57, 65–68.
    DOI: 10.1039/D0CC05270A
  3. “Enhanced CO2 adsorption by insertion reaction in the nanospace of a porphyrin-based MOF”
    M. Morita, S. Kusaka, A. Yonezu, Y. Ohara, H. Sakamoto, R. Matsuda*
    Chem Lett. 2021, In press.
    DOI: 10.1246/cl.200785
  4. “Trapping and Releasing of Oxygen in Liquid by Metal-Organic Framework with Light and Heat”
    M. Fujimura, S. Kusaka, A. Masuda, A. Hori, Y. Hijikata, J. Pirillo, Y. S. Ma, R. Matsuda*
    Small 2021, In press.
    DOI: 10.1002/smll.202004351
  5. “Molecular motion in the nanospace of MOFs upon gas adsorption investigated by in situ Raman spectroscopy”
    S. Kusaka, Y. Nakajima, A. Hori, A. Yonezu, K. Kikushima, W. Kosaka, Y. Ma, R. Matsuda*
    Faraday Discuss. 2021, 225, 70–83.
    DOI: 10.1039/D0FD00002G
  6. “Long-Lived Charge-Transfer State from B-N Frustrated Lewis Pairs Enchained in Supramolecular Copolymers”
    B. Adelizzi, P. Chidchob, N. Tanaka, B. A. G. Lamers, S. C. J. Meskers, S. Ogi, A. R. A. Palmans, S. Yamaguchi, E. W. Meijer
    J. Am. Chem. Soc. 2020, 142, 16681-16689.
    DOI: 10.1021/jacs.0c06921
  7. 57Fe Mossbauer parameters from domain based local pair-natural orbital coupled-cluster theory”
    D. Datta, M. Saitow, B. Sandhofer, F. Neese
    J. Chem. Phys. 2020, 153 204141.
    DOI: 10.1063/5.0022215
  8. “Tuning Gate-Opening of a Flexible Metal-Organic Framework for Ternary Gas Sieving Separation”
    Q. B. Dong, X. Zhang, S. Liu, R. B. Lin, Y. N. Guo, Y. S. Ma, A. Yonezu, R. Krishna, G. P. Liu, J. G. Duan, R. Matsuda, W. Q. Jin, B. L. Chen
    Angew. Chem. Int. Ed. 2020, 59, 22756-22762.
    DOI: 10.1002/anie.202011802
  9. “Capturing roaming molecular fragments in real time”
    T. Endo, S. P. Neville, V. Wanie, S. Beaulieu, C. Qu, J. Deschamps, P. Lassonde, B. E. Schmidt, H. Fujise, M. Fushitani, A. Hishikawa, P. L. Houston, J. M. Bowman, M. S. Schuurman, F. Legare, H. Ibrahim
    Science 2020, 370, 1072-1077.
    DOI: 10.1126/science.abc2960
  10. “Hydrophobicity-driven folding and seeded polymerization of cystine-based dimeric diamides in aqueous media”
    N. Fukaya, S. Ogi, M. Kawashiro, S. Yamaguchi
    Chem. Commun. 2020, 56, 12901-12904.
    DOI: 10.1039/d0cc05255h
  11. “Visualization and understanding of the degradation behaviors of a PEFC Pt/C cathode electrocatalyst using a multi-analysis system combining time-resolved quick XAFS, three-dimensional XAFS-CT, and same-view nano-XAFS/STEM-EDS techniques”
    K. Higashi, S. Takao, G. Samjeske, H. Matsui, M. Tada, T. Uruga, Y. Iwasawa
    Phys. Chem. Chem. Phys. 2020, 22, 18919-18931.
    DOI: 10.1039/d0cp01356k
  12. “Ultrafast Reaction Imaging and Control by Ultrashort Intense Laser Pulses”
    A. Hishikawa, A. Matsuda, M. Fushitani
    Bull. Chem. Soc. J. 2020, 93, 1293-1304.
    DOI: 10.1246/bcsj.20200158
  13. “Oxygen Reduction Reaction Performance Tuning on Pt Nanoparticle/MWCNT Catalysts by Gd Species”
    K. Ichihashi, S. Muratsugu, H. Matsui, K. Higashi, O. Sekizawa, T. Uruga, M. Tada
    J. Phys. Chem. C 2020, 124, 26925-26936.
    DOI: 10.1021/acs.jpcc.0c09308
  14. “Synthesis of Dinuclear Mo-Fe Hydride Complexes and Catalytic Silylation of N-2”
    K. Ishihara, Y. Araki, M. Tada, T. Takayama, Y. Sakai, W. M. C. Sameera, Y. Ohki
    Chem. Eur. J. 2020, 26, 9537-9546.
    DOI: 10.1002/chem.202000104
  15. “Influence of Active Material Loading on Electrochemical Reactions in Composite Solid-State Battery Electrodes Revealed by Operando 3D CT-XANES Imaging”
    Y. Kimura, M. Fakkao, T. Nakamura, T. Okumura, N. Ishiguro, O. Sekizawa, K. Nitta, T. Uruga, M. Tada, Y. Uchimoto, K. Amezawa
    ACS Appl. Ener. Mater. 2020, 3, 7782-7793.
    DOI: 10.1021/acsaem.0c01186
  16. “Reversible structural transformation and redox properties of Cr-loaded iron oxide dendrites studied by in situ XANES spectroscopy”
    H. Matsui, N. Ishiguro, Y. Suzuki, K. Wakamatsu, C. Yamada, K. Sato, N. Maejima, T. Uruga, M. Tada
    Phys. Chem. Chem. Phys. 2020, 22, 28093-28099.
    DOI: 10.1039/d0cp04416d
  17. “Tris(o-phenylenedioxy)cyclotriphosphazene as a Promoter for the Formation of Amide Bonds Between Aromatic Acids and Amines”
    F. S. Movahed, D. N. Sawant, D. B. Bagal, S. Saito
    Synthesis 2020, 52, 3253-3262.
    DOI: 10.1055/s-0040-1707174
  18. “Recent progress in molecularly imprinted approach for catalysis”
    S. Muratsugu, S. Shirai, M. Tada
    Tetrahedron Lett. 2020, 61 151603.
    DOI: 10.1016/j.tetlet.2020.151603
  19. “Quick Operando Ambient Pressure Hard X-ray Photoelectron Spectroscopy for Reaction Kinetic Measurements of Polymer Electrolyte Fuel Cells”
    T. Nakamura, Y. Takagi, S. Chaveanghong, T. Uruga, M. Tada, Y. Iwasawa, T. Yokoyama
    J. Phys. Chem. C 2020, 124, 17520-17527.
    DOI: 10.1021/acs.jpcc.0c04871
  20. “A dinuclear Mo2H8complex supported by bulky C5H2tBu3 ligands”
    Y. Ohki, K. Ishihara, M. Yaoi, M. Tada, W. M. C. Sameera, R. E. Cramer
    Chem. Commun. 2020, 56, 8035-8038.
    DOI: 10.1039/d0cc03274c
  21. “Characterization of soft X-ray FEL pulse duration with two-color photoelectron spectroscopy”
    S. Owada, M. Fushitani, A. Matsuda, H. Fujise, Y. Sasaki, Y. Hikosaka, A. Hishikawa, M. Yabashi
    J. Synchrotron Rad. 2020, 27, 1362-1365.
    DOI: 10.1107/s1600577520008516
  22. “µ-Nitrido-bridged iron phthalocyanine dimer bearing eight peripheral 12-crown-4 units and its methane oxidation activity”
    Y. Yamada, J. Kura, Y. Toyoda, K. Tanaka
    New J. Chem. 2020, 44, 19179-19183.
    DOI: 10.1039/d0nj04601a
  23. “Development of functional molecular assemblies based on programmable construction of face-to-face assemblies of metallo-porphyrinoids”
    Y. Yamada, K. Tanaka
    J. Inclusion Phenomena and Macrocyclic Chem. 2020, 96, 197-213.
    DOI: 10.1007/s10847-019-00969-9
  24. “Reaction of H2 with mitochondria-relevant metabolites using a multifunctional molecular catalyst”
    S. Yoshioka, S. Nimura, M. Naruto, S. Saito
    Science Advances 2020, 6.
    DOI: 10.1126/sciadv.abc0274
  25. “Quantum Spin Liquid State in a Two-Dimensional Semiconductive Metal–Organic Framework”
    Y. Misumi, A. Yamaguchi*, Z. Zhang*, T. Matsushita, N. Wada, M. Tsuchiizu, K. Awaga*
    J. Am. Chem. Soc. 2020, 142, 16513–16517.
    DOI: 10.1021/jacs.0c05472
  26. “Multielectron-Ion Coincidence Spectroscopy of Xe in Extreme Ultraviolet Laser Fields: Nonlinear Multiple Ionization via Double Core-Hole States”
    M. Fushitani, Y. Sasaki, A. Matsuda, H. Fujise, Y. Kawabe, K. Hashigaya, S. Owada, T. Togashi, K. Nakajima, M. Yabashi, Y. Hikosaka, A. Hishikawa*
    Phys. Rev. Lett. 2020, 124, 193201.
    DOI: 10.1103/PhysRevLett.124.193201

    Press Release (in Japanese)

  27. “Mechanistic Understanding of the Heterogeneous, Rhodium-Cyclic (Alkyl)(Amino)Carbene-Catalyzed (Fluoro-)Arene Hydrogenation”
    D. Moock, M. P. Wiesenfeldt, M. Freitag, S. Muratsugu, S. Ikemoto, R. Knitsch, J. Schneidewind, W. Baumann, A. H. Schäfer, A. Timmer, M. Tada, M. R. Hansen, F. Glorius*
    ACS Catal. 2020, 10, 6309–6317.
    DOI: 10.1021/acscatal.0c01074
  28. “3D Operando Imaging and Quantification of Inhomogeneous Electrochemical Reactions in Composite Battery Electrodes”
    Y. Kimura*, A. Tomura, M. Fakkao, T. Nakamura, N. Ishiguro, O. Sekizawa, K. Nitta,T. Uruga, T. Okumura, M. Tada, Y. Uchimoto, K. Amezawa
    J. Phys. Chem. Lett. 2020, 11, 3629–3636.
    DOI: 10.1021/acs.jpclett.0c00876
  29. “Feed Gas Exchange (Startup/Shutdown) Effects on Pt/C Cathode Electrocatalysis and Surface Pt-Oxide Behavior in Polymer Electrolyte Fuel Cells As Revealed Using In Situ Real-Time XAFS and High-Resolution STEM Measurements”
    G. Samjeské, T. Kaneko, T. Gunji, K. Higashi, T. Uruga, M. Tada, Y. Iwasawa*
    Phys. Chem. Chem. Phys. 2020, 22, 9424–9437.
    DOI: 10.1039/c9cp06895c
  30. “Recent Progress in Molecularly Imprinted Approach for Catalysis”
    S. Muratsugu*, S. Shirai, M. Tada*
    Tetrahedron Lett. 2020, 61, 151603. [Invited Digest]
    DOI: 10.1016/j.tetlet.2020.151603
  31. “Copper Complexes Bearing a Dianionic Diborane(4) Ligand: Synthesis and Evaluation of the Donor Property”
    S. Akiyama, S. Ikemoto, S. Muratsugu*, M. Tada*, M. Yamashita*
    Organometallics 2020, 39, 500–504.
    DOI: 10.1021/acs.organomet.0c00027
  32. “Molecular simulation study on the flexibility in the interpenetrated metal–organic framework LMOF-201 using reactive force field”
    A. Agrawal, M. Agrawal, D. Suh, Y. Ma, R. Matsuda, A. Endo, W. L. Hsu, H. Daiguji*
    J. Mater. Chem. A 2020, 8, 16385–16391.
    DOI: 10.1039/C9TA12065C
  33. “Augmenting the Carbon Dioxide Uptake and Selectivity of Metal–Organic Frameworks by Metal Substitution: Molecular Simulations of LMOF-202”
    A. Agrawal, M. Agrawal, D. Suh, S. Fei, A. Alizadeh, Y. Ma, R. Matsuda, W. L. Hsu, H. Daiguji*
    ACS Omega 2020, 5, 17193–17198.
    DOI: 10.1021/acsomega.0c01267
  34. “Swift and Efficient Nuclear Spin Conversion of Molecular Hydrogen Confined in Prussian Blue Analogs”
    Y. Ohtsubo, A. Mishima, A. Hori, R. Matsuda, R. Ohtani, M. Ohba*
    Chem. Lett. 2020, 49, 149–152.
    DOI: 10.1246/cl.190829
  35. “Pseudo Gated Adsorption with Negligible Volume Change Evoked by Halogen Bond Interaction in the Nanospace of MOFs”
    P. Kanoo, R. Matsuda*, H. Sato, L. Li, N. Hosono, S. Kitagawa*
    Chem. Eur. J. 2020, 26, 2148–2153.
    DOI: 10.1002/chem.201904703
  36. “Direct Observation of Dimethyl Sulfide Trapped by MOF Proving Efficient Removal of Sulfur Impurities”
    M. Morita, A. Yonezu, S. Kusaka, A. Hori, Y. Ma, R. Matsuda*
    RSC Adv. 2020, 10, 4710–4714.
    DOI: 10.1039/c9ra09702c
  37. “Accelerated C2H2/CO2 Separation by a Se-Functionalized Porous Coordination Polymer with Low Binding Energy”
    Q. Dong, Y. Guo, H. Cao, S. Wang, R. Matsuda, J. Duan*
    ACS Appl. Mater. Interfaces 2020, 12, 3764–3772.
    DOI: 10.1021/acsami.9b20623
  38. “Photocatalytic CO2 Reduction Using a Robust Multifunctional Iridium Complex toward the Selective Formation of Formic Acid”
    K. Kamada, J. Jung*, T. Wakabayashi, K. Sekizawa, S. Sato, T. Morikawa, S. Fukuzumi, S. Saito*
    J. Am. Chem. Soc. 2020, 142, 10261–10266.
    DOI: 10.1021/jacs.0c03097
  39. “Catalytic Hydrogenation of N‐protected α‐Amino Acids Using Ruthenium Complexes with Monodentate Phosphine Ligands”
    A. Saito, S. Yoshioka, M. Naruto, S. Saito*
    Adv. Synth. Catal. 2020, 362, 424–429.
    DOI: 10.1002/adsc.201901298
  40. “Design and Synthesis of Cyclometalated Iridium(Iii) Complexes-Chromophore Hybrids That Exhibit Long-Emission Lifetimes Based On A Reversible Electronic Energy Transfer Mechanism”
    A. Kazama, Y. Imai, Y. Okayasu, Y. Yamada, J. Yuasa, S Aoki*
    Inorg. Chem. 2020, 59, 6905–6922.
    DOI: 10.1021/acs.inorgchem.0c00363
  41. “Development of Functional Molecular Assemblies Based on Programmable Construction of Face-to-Face Assemblies of Metallo-Porphyrinoids”
    Y. Yamada*, K. Tanaka*
    J. Incl. Phenom. Macrocycl. Chem. 2020, 96, 197–213.
    DOI: 10.1007/s10847-019-00969-9
  42. “One-pot Synthesis of Cyclic Oligosaccharides by the Polyglycosylation of Monothioglycosides”
    H. Someya, T. Seki, G. Ishigami, T. Itoh, Y. Saga, Y. Yamada, S. Aoki*
    Carbohydrate Res. 2020, 487, 107888.
    DOI: 10.1016/j.carres.2019.107888
  43. “A Multireference Coupled-Electron Pair Approximation Combined with Complete-Active Space Perturbation Theory in Local Pair-Natural Orbital Framework”
    M. Saitow*, T. Yanai
    J. Chem. Phys. 2020, 152, 11411
    DOI: 10.1063/1.5142622
  44. “Linear Scaling Perturbative Triples Correction Approximations for Open-Shell Domain-Based Local Pair Natural Orbital Coupled Cluster Singles and Doubles Theory [DLPNO-CCSD (T0/T)]”
    Y. Guo, C. Riplinger, D. G. Liakos, U. Becker, M. Saitow, F. Neese*
    J. Chem. Phys. 2020, 152, 024116
    DOI: 10.1063/1.5127550
  45. “Reversible Low-Temperature Redox Activity and Selective Oxidation Catalysis Derived from Concerted Activation of Multiple Metal Species on Cr and Rh-Incorporated Ceria Catalysts”
    S. Ikemoto, X. Huang, S. Muratsugu*, S. Nagase, T. Koitaya, H. Matsui, G. Yokota, T. Sudoh, A. Hashimoto, Y. Tan, S. Yamamoto, J. Tang, I. Matsuda, J. Yoshinobu, T. Yokoyama, S. Kusaka, R. Matsuda, M. Tada*
    Phys. Chem. Chem. Phys. 2019, 21, 20868–20877.
    DOI: 10.1039/c9cp04625a
  46. “Synthesis of A Pincer-IrV Complex with A Base-Free Alumanyl Ligand and Its Application toward the Dehydrogenation of Alkanes”
    S. Morisako, S. Watanabe, S. Ikemoto, S. Muratsugu, M. Tada*, M. Yamashita*
    Angew. Chem. Int. Ed. 2019, 58, 15031–15035.
    DOI: 10.1021/10.1002/anie.201909009
  47. “Pt-Co/C Cathode Catalyst Degradation in a Polymer Electrolyte Fuel Cell Investigated by an Infographic Approach Combining Three-Dimensional Spectroimaging and Unsupervised Learning”
    Y. Tan, H. Matsui, N. Ishiguro, T. Uruga, D. N. Nguyen, O. Sekizawa, T. Sakata, N. Maejima, K. Higashi, H. C. Dam*, M. Tada*
    J. Phys. Chem. C 2019, 123, 18844–18853. [Selected as Supplementary Cover of JPCC]
    DOI: 10.1021/acs.jpcc.9b05005
  48. “SPring-8 BL36XU: Synchrotron Radiation X-ray-based Multi-analytical Beamline for Polymer Electrolyte Fuel Cells under Operating Conditions”
    T. Uruga*, M. Tada, O. Sekizawa, Y. Takagi, T. Yokoyama, Y. Iwasawa*
    Chem. Rec. 2019, 19, 1444–1456.
    DOI: 10.1002/tcr.201800193
  49. Operando XAFS Imaging of Distribution of Pt Cathode Catalysts in PEFC MEA”
    H. Matsui*, N. Maejima, N. Ishiguro, Y. Tan, T. Uruga, O. Sekizawa, T. Sakata, M. Tada*
    Chem. Rec. 2019, 19, 1380–1392. [Invited personal accounts]
    DOI: 10.1002/tcr.201800123
  50. “Enhanced Oxygen Reduction Reaction Performance of Size-controlled Pt Nanoparticles on Polypyrrole-functionalized Carbon Nanotubes”
    K. Ichihashi, S. Muratsugu*, S. Miyamoto, K. Sakamoto, N. Ishiguro, and M. Tada*
    Dalton Trans. 2019, 48, 7130–7137. [Inside Front Cover]
    DOI: 10.1039/c9dt00158a
  51. “Oxygen-diffusion-driven oxidation behavior and tracking areas visualized by X-ray spectro-ptychography with unsupervised learning
    M. Hirose, N. Ishiguro, K. Shimomura, D. N. Nguyen, H. Matsui, H. C. Dam*, M. Tada*, Y. Takahashi*
    Commun. Chem. 2019, 2, 50.
    DOI: 10.1038/s42004-019-0147-y
  52. “Kinetics of Water Vapor Adsorption and Desorption in MIL-101 Metal-Organic Frameworks”
    K. Yanagita, J. Hwang, J. A. Shamim, W.-L. Hsu, R. Matsuda, A. Endo, J.-J. Delaunay, H. Daiguji*
    J. Phys. Chem. C 2019, 123, 387–398.
    DOI: 10.1021/acs.jpcc.8b08211
  53. “Grafting Free Carboxylic Acid Groups onto the Pore Surface of 3D Porous Coordination Polymers for High Proton Conductivity”
    Y. Tian, G. Liang, T. Fan, J. Shang, S. Shang, Y. Ma, R. Matsuda, M. Liu, M. Wang, L. Li*, S. Kitagawa*
    Chem. Mater. 2019, 31, 8494–8503.
    DOI: 10.1021/acs.chemmater.9b02924
  54. “Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework”
    S. Kusaka, A. Kiyose, H. Sato, Y. Hijikata, A. Hori, Y. Ma, R. Matsuda*
    J. Am. Chem. Soc. 2019, 141, 15742–15746.
    DOI: 10.1021/jacs.9b07682
  55. “One-Step Synthesis Of An Adaptive Nanographene Mof: Adsorbed Gas-Dependent Geometrical Diversity”
    S. Suginome, H. Sato*, A. Hori, A. Mishima, Y. Harada, S. Kusaka, R. Matsuda, J. Pirillo, Y. Hijikata, T. Aida*
    J. Am. Chem. Soc. 2019, 141, 15649–15655.
    DOI: 10.1021/jacs.9b07732
  56. “Microwave-Assisted Hydrothermal Synthesis of [Al(OH)(1,4-NDC)] Membranes with Superior Separation Performances”
    Y. Liu*, A. Hori, S. Kusaka, N. Hosono, M. Li, A. Guo, D. Du, Y. Li, W. Yang, Y. Ma, R. Matsuda*
    Chem. Asian. J. 2019, 14, 2072–2076.
    DOI: 10.1002/asia.201900152
  57. “Angle Dependence of Dissociative Tunneling Ionization of NO in Asymmetric Two-Color Intense Laser Fields”
    T. Endo, H. Fujise, H. Hasegawa, A. Matsuda, M. Fushitani. O. I. Tolstikhin, T. Morishita, A. Hishikawa*
    Phys. Rev. A 2019, 100, 053422.
    DOI: 10.1103/PhysRevA.100.053422
  58. “Probing Rydberg-Rydberg Interactions in N2 by Ultrafast EUV-NIR Photoelectron Spectroscopy”
    M. Fushitani. Y. Toida, F. Légaré and A. Hishikawa
    Opt. Express 2019, 27, 19702–19711.
    DOI: 10.1364/OE.27.019702
  59. “Catalytic Methane Oxidation by Supramolecular Conjugate Based on µ-Nitrido-Bridged Iron Porphyrinoid Dimer”
    Y. Yamada*, K. Morita, N. Mihara, K. Igawa, K. Tomooka, K. Tanaka*
    New. J. Chem. 2019, 43, 11477–11482. [Selected as Outside Front Cover Picture]
    DOI: 10.1039/c9nj02210d
  60. “Improved Synthesis of Monocationic µ-Nitrido-Bridged Iron Phthalocyanine Dimer with No Peripheral Substituents”
    Y. Yamada*, T. Sugiura, K. Morita, H. Ariga-Miwa, K. Tanaka*
    Inorg. Chim. Acta 2019, 489, 160–163.
    DOI: 10.1016/j.ica.2019.02.021
  61. “Hydrophobicity and CH/π-Interaction-Driven Self-assembly of Amphiphilic Aromatic Hydrocarbons into Nanosheets”
    T. Nishikawa, H. Narita, S. Ogi*, Y. Sato, S. Yamaguchi*
    Chem. Commun. 2019, 55, 14950–14953.
    DOI: 10.1039/c9cc08070h
  62. “Seeded Polymerization of an Amide-Functionalized Diketopyrrolopyrrole Dye in Aqueous Media”
    S. Ogi, N. Fukaya, Arifin, B. B. Skjelstad, Y. Hijikata, S. Yamaguchi*
    Chem. Eur. J. 2019, 25, 7303–7307.
    DOI: 10.1002/chem.201901382
  63. “Exploration of Li-Organic Batteries Using Hexaphyrin as an Active Cathode Material”
    J.-Y. Shin, Z. Zhang, K. Awaga, H. Shinokubo
    Molecules 2019, 55, 2433
    DOI: 10.3390/molecules24132433
  64. “A Domain-Based Local Pair Natural Orbital Implementation of the Equation of Motion Coupled Cluster Method for Electron Attached States”
    A. K. Dutta, M. Saitow, B. Demoulin, F. Neese*, R. Izsák*
    J. Chem. Phys. 2019, 150, 164123
    DOI: 10.1063/1.5089637