Publications

Chen, Z., Osada, M., Li, D., Been, E., Chen, S.-D., Hashimoto, M., Lu, D., Mo, S.-K., Lee, K., Wang, B., Rodolakis, F., McChesney, J., Jia, C., Moritz, B., Devereaux, T., Hwang, H., & Shen, Z.-X. (2022). Electronic structure of superconducting nickelates probed by resonant photoemission spectroscopy. Matter, 5, 1806-1815. https://doi.org/10.1016/j.matt.2022.01.020

Kas, J., Vila, F., Tan, T., & Rehr, J. (2022). Ab initio calculation of X-ray and related core-level spectroscopies: Green’s function approaches. Physical Chemistry Chemical Physics, In Press. https://doi.org/10.1039/D2CP01167K

Kas, J., Rehr, J., & Devereaux, T. (2022). Ab Initio Multiplet-Plus-Cumulant Approach for Correlation Effects in X-Ray Photoelectron Spectroscopy. Physical Review Letters, 128, 216401. https://doi.org/10.1103/PhysRevLett.128.216401

Zhang, H., Bao, C., Schüler, M., Zhou, S., Li, Q., Luo, L., Yao, W., Wang, Z., Devereaux, T., & Zhou, S. (2022). Self-energy dynamics and the mode-specific phonon threshold effect in Kekulé-ordered graphene. National Science Review, 9, nwab175. https://doi.org/10.1093/nsr/nwab175

Huang, X.-X., Moritz, B., Claassen, M., & Devereaux, T. (2022). Sign-free determinant quantum Monte Carlo study of excitonic density orders in a two-orbital Hubbard-Kanamori model. Physical Review B, 105, 165124. https://doi.org/10.1103/PhysRevB.105.165124

Wang, Z.-C., Been, E., Gaudet, J., Alqasseri, G., Fruhling, K., Yao, X., Stuhr, U., Zhu, Q., Ren, Z., Cui, Y., Jia, C., Moritz, B., Chowdhury, S., Devereaux, T., & Tafti, F. (2022). Anisotropy of the magnetic and transport properties of EuZn2As2. Physical Review B, 105, 165122. https://doi.org/10.1103/PhysRevB.105.165122

Been, E., Hsu, K., Hu, Y., Moritz, B., Cui, Y., Jia, C., & Devereaux, T. (2022). On the Nature of Valence Charge and Spin Excitations via Multi-Orbital Hubbard Models for Infinite-Layer Nickelates. Frontiers in Physics, 10, 836959. https://doi.org/10.3389/fphy.2022.836959

Schüler, M., Pincelli, T., Dong, S., Devereaux, T., Wolf, M., Rettig, L., Ernstorfer, R., & Beaulieu, S. (2022). Polarization-Modulated Angle-Resolved Photoemission Spectroscopy: Toward Circular Dichroism without Circular Photons and Bloch Wave-function Reconstruction. Physical Review X, 12, 011019. https://doi.org/10.1103/PhysRevX.12.011019

Rossi, M., Lu, H., Nag, A., Li, D., Osada, M., Lee, K., Wang, B., Agrestini, S., Garcia-Fernandez, M., Kas, J., Chuang, Y.-D., Shen, Z. X., Hwang, H., Moritz, B., Zhou, K.-J., Devereaux, T., & Lee, W. S. (2021). Orbital and spin character of doped carriers in infinite-layer nickelates. Physical Review B, 104, L220505. https://doi.org/10.1103/PhysRevB.104.L220505

Peng, C., Jiang, Y.-F., Wang, Y., & Jiang, H.-C. (2021). Gapless spin liquid and pair density wave of the Hubbard model on three-leg triangular cylinders. New Journal of Physics, 23, 123004. https://doi.org/10.1088/1367-2630/ac3a83

Tang, T., Wang, Y., Moritz, B., & Devereaux, T. (2021). Orbitally selective resonant photodoping to enhance superconductivity. Physical Review B, 104, 174516. https://doi.org/10.1103/PhysRevB.104.174516

Kas, J., Vila, F., Pemmaraju, C., Tan, T., & Rehr, J. (2021). Advanced calculations of X-ray spectroscopies with FEFF10 and Corvus. Journal of Synchrotron Radiation, 28, 1801-1810. https://doi.org/10.1107/S1600577521008614

Kas, J., Vila, F., Pemmaraju, C., Prange, M., Persson, K., Yang, R., & Rehr, J. (2021). Full spectrum optical constant interface to the Materials Project. Computational Materials Science, 201, 110904. https://doi.org/10.1016/j.commatsci.2021.110904

Rehr, J., & Kas, J. (2021). Strengths of plasmon satellites in XPS: Real-time cumulant approach. Journal of Vacuum Science & Technology A, 39, 060401. https://doi.org/10.1116/6.0001173

Devereaux, T., Moritz, B., Jia, C., Kas, J., & Rehr, J. (2021). Web-based methods for X-ray and photoelectron spectroscopies. Computational Materials Science, 200, 110814. https://doi.org/10.1016/j.commatsci.2021.110814

Dupont, M., Sherman, N., & Moore, J. (2021). Spatiotemporal Crossover between Low- and High-Temperature Dynamical Regimes in the Quantum Heisenberg Magnet. Physical Review Letters, 127, 107201. https://doi.org/10.1103/PhysRevLett.127.107201

Schwartz, C., Ra, S., Jamnuch, S., Hull, C., Miotti, P., Lam, R., Nordlund, D., Uzundal, C., Pemmaraju, C., Mincigrucci, R., Foglia, L., Simoncig, A., Coreno, M., Masciovecchio, C., Giannessi, L., Poletto, L., Principi, E., Zuerch, M., Pascal, T., Drisdell, W., & Saykally, R. (2021). Angstrom-Resolved Interfacial Structure in Buried Organic-Inorganic Junctions. Physical Review Letters, 127, 096801. https://doi.org/10.1103/PhysRevLett.127.096801

Cookmeyer, T., Motruk, J., & Moore, J. (2021). Four-Spin Terms and the Origin of the Chiral Spin Liquid in Mott Insulators on the Triangular Lattice. Physical Review Letters, 127, 087201. https://doi.org/10.1103/PhysRevLett.127.087201

Tan, T., Kas, J., & Rehr, J. (2021). Real-space Green’s function approach for x-ray spectra at high temperature. Physical Review B, 104, 035144. https://doi.org/10.1103/PhysRevB.104.035144

Gilmore, K., Pelliciari, J., Huang, Y., Kas, J., Dantz, M., Strocov, V., Kasahara, S., Matsuda, Y., Das, T., Shibauchi, T., & Schmitt, T. (2021). Description of Resonant Inelastic X-Ray Scattering in Correlated Metals. Physical Review X, 11, 031013. https://doi.org/10.1103/PhysRevX.11.031013