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Negative differential resistance and quantum oscillations in FeSb2 with embedded antimony

Fangdong Tang, Qianheng Du, Cedomir Petrovic, Wei Zhang, Mingquan He and Liyan Zhang, Chin.
Phys. B 28, 037104 (2019)

Fe0.36(4) Pd 0.64(4) Se2 : Magnetic Spin-Glass Polymorph of FeSe2 and PdSe2 Stable at Ambient Pressure

Jianjun Tian, Valentin N. Ivanovski, David Szalda, Hechang Lei, Aifeng Wang, Yu Liu, Weifeng Zhang, Vasil Koteski, and Cedomir Petrovic.
Inorg. Chem. 58, 5, 3107-3114 (2019)

Machine learning electron correlation in a disordered medium

Jianhua Ma, Puhan Zhang, Yaohua Tan, Avik W. Ghosh, and Gia-Wei Chern.
Phys. Rev. B 99, 085118 (2019)

High temperature singlet-based magnetism from Hund’s rule correlations

Lin Miao, Rourav Basak, Sheng Ran, Yishuai Xu, Erica Kotta, Haowei He, Jonathan D. Denlinger, Yi-De Chuang, Y. Zhao, Z. Xu, J.W. Lynn, J.R. Jeffries, S.R. Saha, Ioannis Giannakis, Pegor Aynajian, Chang-Jong Kang, Yilin Wang, Gabriel Kotliar, Nicholas P. Butch and L. Andrew Wray.
Nature Communications 10, 644 (2019)

Spectroscopic and first principle DFT+eDMFT study of complex structural, electronic, and vibrational properties of M2Mo3O8 (M=Fe, Mn) polar magnets

T. N. Stanislavchuk, G. L. Pascut, A. P. Litvinchuk, Z. Liu, S. Choi, M. J. Gutmann, B. Gao, K. Haule, V. Kiryukhin, S.-W. Cheong, and A. A. Sirenko.
arXiv:1902.02325

Anisotropic magnetic entropy change in Cr2X2Te6 (X=Si and Ge)

Yu Liu and C. Petrovic.
Phys. Rev. Materials 3, 014001 (2019)

Rotationally invariant slave-boson and density matrix embedding theory: A unified framework and a comparative study on the 1D and 2D Hubbard Model

Tsung-Han Lee, Thomas Ayral, Yong-Xin Yao, Nicola Lanata, and Gabriel Kotliar.
arXiv:1812.09820

Correlated materials design: prospects and challenges

Ran Adler, Chang-Jong Kang, Chuck-Hou Yee, and Gabriel Kotliar.
Reports on Progress in Physics 82, 1 (2018)

EDRIXS: An open source toolkit for simulating spectra of resonant inelastic x-ray scattering

Y. L. Wang, G. Fabbris, M. P. M. Dean, and G. Kotliar.
arXiv:1812.05735

Anomalous Hall effect in the trigonal Cr5Te8 single crystal

Yu Liu and C. Petrovic.
Phys. Rev. B 98, 195122 (2018)

Machine learning for molecular dynamics with strongly correlated electrons

Hidemaro Suwa, Justin S. Smith, Nicholas Lubbers, Cristian D. Batista, Gia-Wei Chern, and Kipton Barros.
arXiv:1811.01914 (2018)

Anisotropic Correlated Electronic Structure of Colossal Thermopower Marcasite FeSb2

A. Chikina, J.-Z. Ma, W. H. Brito, S. Choi, Q. Du, J. Jandke, H. Liu, N. C. Plumb, M. Shi, C. Petrovic, M. Radovic, and G. Kotliar.
arXiv:1810.12284 (2018)

ComDMFT: a Massively Parallel Computer Package for the Electronic Structure of Correlated-Electron Systems

Sangkook Choi, Patrick Semon, Byungkyun Kang, Andrey Kutepov, and Gabriel Kotliar.
arXiv:1810.01679 (2018)

Direct detection of dimer orbitals in Ba5AlIr2O11

Y. Wang, Ruitang Wang, Jungho Kim, M. H. Upton, D. Casa, T. Gog, G. Cao, G. Kotliar, M. P. M. Dean, and X. Liu.
arXiv:1810.05243 (2018)

Thermoelectric studies of Ir1-xRhxTe2 (0≤x≤0.3)

Yu Liu, Hechang Lei, Kefeng Wang, Milinda Abeykoon, J. B. Warren, Emil Bozin, and C. Petrovic.
Phys. Rev. B 98, 094519 (2018)

Electronic structure and thermoelectric properties of CoAsSb with post-DFT approaches

Andrey L. Kutepov and Anthony Ruth.
arXiv:1809.08591 (2018)

Vertex corrections in self-consistent GWΓ calculations: ground state properties of vanadium

Andrey L Kutepov.
arXiv:1809.06654 (2018)

Evidence of spin-phonon coupling in CrSiTe3

A. Milosavljević, A. Šolajić, J. Pešić, Yu Liu, C. Petrovic, N. Lazarević, and Z. V. Popović.
Phys. Rev. B 98, 104306 (2018)

Lattice dynamics and phase transition in CrI3 single crystals

S. Djurdjić-Mijin, A. Šolajić, J. Pešić, M. Šćepanović, Y. Liu (刘育), A. Baum, C. Petrovic, N. Lazarević, and Z. V. Popović.
Phys. Rev. B 98, 104307 (2018)

Critical behavior and magnetocaloric effect in Mn3Si2Te6

Yu Liu and C. Petrovic.
Phys. Rev. B 98, 064423 (2018)

Unusual electronic and vibrational properties in the colossal thermopower material FeSb2

C. C. Homes, Q. Du, C. Petrovic, W. H. Brito, S. Choi, and G. Kotliar,
Scientific Reports 8: 11692 (2018)

Orbital-dependent correlations in PuCoGa5

W. H. Brito, S. Choi, Y. X. Yao, and G. Kotliar,
Phys. Rev. B 98, 035143 (2018)

Universal 2Δmax/kBTc scaling decoupled from the electronic coherence in iron-based superconductors

H. Miao, W. H. Brito, Z. P. Yin, R. D. Zhong, G. D. Gu, P. D. Johnson, M. P. M. Dean, S. Choi, G. Kotliar, W. Ku, X. C. Wang, C. Q. Jin, S.-F. Wu, T. Qian, and H. Ding,
Phys. Rev. B 98, 020502(R) (2018)

Toward a predictive theory of correlated materials

Paul R. C. Kent and Gabriel Kotliar,
Science 361, 348 (2018)

Thermoelectric Properties of CoAsSb: An Experimental and Theoretical Study

Xiaoyan Tan, Kasey P. Devlin, Xiaoyu Deng, Chang-Jong Kang, Mark Croft, Corey E. Frank, Chongin Pak, Saul Lapidus, Susan M. Kauzlarich, Valentin Taufour, Gabriel Kotliar, and Martha Greenblatt,
Chem. Mater., 30 (13), pp 4207–4215 (2018)

Anisotropic magnetocaloric effect in single crystals of CrI3

Yu Liu and C. Petrovic,
Phys. Rev. B 97, 174418 (2018)

Anomalous Hall effect in the van der Waals bonded ferromagnet Fe3-xGeTe2

Yu Liu, Eli Stavitski, Klaus Attenkofer, and C. Petrovic,
Phys. Rev. B 97, 165415 (2018)

Polaronic transport and thermoelectricity in Fe1-xCoxSb2S4 (x=0, 0.1 and 0.2)

Yu Liu, Chang-Jong Kang, Eli Stavitski, Qianheng Du, Klaus Attenkofer, G. Kotliar, and C. Petrovic,
Phys. Rev. B 97, 155202 (2018)

Nonequilibrium dynamics of superconductivity in the attractive Hubbard model

G.-W. Chern, K. Barros,
arXiv:1803.04118 (2018)

Gradient-based stochastic estimation of the density matrix

Z. Wang, G.-W. Chern, C. D. Batista, and K. Barros,
The Journal of Chemical Physics 148, 094107 (2018)

Structural predictions for Correlated Electron Materials Using the Functional Dynamical Mean Field Theory Approach

Kristjan Haule,
J. Phys. Soc. Jpn. 87, 041005 (2018)

Three-dimensional magnetic critical behavior in CrI3

Yu Liu and C. Petrovic,
Phys. Rev. B 97, 014420 (2018)

Semiclassical dynamics of spin density waves

G.-W. Chern, K. Barros, Z. Wang, H. Suwa, C. D. Batista,
Phys. Rev. B 97,035120 (2018)

Uncovering the Origin of Divergence in the CsM(CrO4)2 (M = La, Pr, Nd, Sm, Eu; Am) Family through Examination of the Chemical Bonding in a Molecular Cluster and by Band Structure Analysis

Shane S. Galley, Alexandra A. Arico, Tsung-Han Lee, Xiaoyu Deng, Yong-Xin Yao, Joseph M. Sperling, Vanessa Proust, Julia S. Storbeck, Vladimir Dobrosavljevic, Jennifer N. Neu, Theo Siegrist, Ryan E. Baumbach, Thomas E. Albrecht-Schmitt, Nikolas Kaltsoyannis, and Nicola Lanatà,
Am. Chem. Soc., 140 (5), pp 1674–1685 (2018)

Effects of interaction strength, doping, and frustration on the antiferromagnetic phase of the two-dimensional Hubbard model

L. Fratino, M. Charlebois, P. Sémon, G. Sordi, and A.-M. S. TremblayL. Fratino, M. Charlebois, P. Sémon, G. Sordi, and A.-M. S. Tremblay,
Phys. Rev. B 96, 241109(R) (2017)

Cuprate phase diagram and the influence of nanoscale inhomogeneities

N. Zaki, H.-B. Yang, J. D. Rameau, P. D. Johnson, H. Claus, and D. G. Hinks,
Phys. Rev. B 96, 195163 (2017)

Dynamic inhomogeneities and phase separation after quantum quenches in strongly correlated systems

G.-W. Chern,
arXiv:1711.07972 (2017)

Pressure-driven insulator-metal transition in cubic phase UO2

Li Huang, Yilin Wang, and Philipp Werner,
Europhysics Letter 119, 5 (2017)

Spin-density fluctuations and the fluctuation-dissipation theorem in 3d ferromagnetic metals

A. L. Wysocki, V. N. Valmispild, A. Kutepov, S. Sharma, J. K. Dewhurst, E. K. U. Gross, A. I. Lichtenstein, and V. P. Antropov,
Phys. Rev. B 96, 184418 (2017)

Observation of an emergent coherent state in the iron-based superconductor KFe2As2

Run Yang, Zhiping Yin, Yilin Wang, Yaomin Dai, Hu Miao, Bing Xu, Xianggang Qiu, and Christopher C. Homes,
Phys. Rev. B 96, 201108(R) (2017)

Emergent Bloch Excitations in Mott Matter

Nicola Lanatà, Tsung-Han Lee, Yongxin Yao, and Vladimir Dobrosavljević,
Phys. Rev. B 96, 195126 (2017)

Ground state properties of 3d metals from self-consistent GW approach

Andrey L Kutepov,
J.Phys. Condens. Matter 29, 465503 (2017)

Critical behavior of the van der Waals bonded ferromagnet Fe3-xGeTe

Yu Liu, V. N. Ivanovski, and C. Petrovic,
Phys. Rev. B 96, 144429 (2017)

Critical behavior of the quasi-two-dimensional weak itinerant ferromagnet trigonal chromium telluride Cr0.62Te

Yu Liu and C. Petrovic,
Phys. Rev. B 96, 134410 (2017)

Mott Transition and Magnetism in Rare Earth Nickelates and its Fingerprint on the X-ray Scattering

Kristjan Haule and Gheorghe L. Pascut,
Scientific Reports 7, 10375 (2017)

On the possibility to detect multipolar order in URu2Si2 by the electric quadrupolar transition of resonant elastic x-ray scattering

Y. L. Wang, G. Fabbris, D. Meyers, N. H. Sung, R. E. Baumbach, E. D. Bauer, P. J. Ryan, J.-W. Kim, X. Liu, M. P. M. Dean, G. Kotliar, and X. Dai,
Phys. Rev. B 96, 085146 (2017)

Signatures of Mottness and Hundness in archetypal correlated metals

Xiaoyu Deng, Katharina M. Stadler, Kristjan Haule, Andreas Weichselbaum, Jan von Delft, and Gabriel Kotliar,
arXiv:1708.05752 (2017)

Critical behavior of quasi-two-dimensional semiconducting ferromagnet Cr2Ge2Te6

Yu Liu and C. Petrovic,
Phys. Rev. B 96, 054406 (2017)

One-electron spectra and susceptibilities of the three-dimensional electron gas from self-consistent solutions of Hedin's equations.

Andrey L. Kutepov and G. Kotliar,
Phys. Rev. B 96, 035108 (2017)

Linearized self-consistent quasiparticle GW method: Application to semiconductors and simple metals.

Andrey L. Kutepov, Viktor S. Oudovenko, and Gabriel Kotliar,
Comput. Phys. Comm., 219, p. 407 (2017)

Mott Transition in a Metallic Liquid: Gutzwiller Molecular Dynamics Simulations

Gia-Wei Chern, Kipton Barros, Cristian D. Batista, Joel D. Kress, and Gabriel Kotliar,
Phys. Rev. Lett. 118, 226401 (2017) 

Slave Boson Theory of Orbital Differentiation with Crystal Field Effects: Application to UO2

Nicola Lanatà, Yongxin Yao, Xiaoyu Deng, Vladimir Dobrosavljević, and Gabriel Kotliar,
Phys. Rev. Lett. 118, 126401 (2017)

Self-consistent solution of Hedin's equations: Semiconductors and insulators.

Andrey L. Kutepov,
Phys. Rev. B 95, 195120 (2017)

Quantum critical point revisited by dynamical mean-field theory

Wenhu Xu, Gabriel Kotliar, and Alexei M. Tsvelik,
Phys. Rev. B 95, 121113(R) (2017)

Superconducting order from disorder in 2H-TaSe 2−x Sx

Lijun Li, Xiaoyu Deng, Zhen Wang, Yu Liu, Milinda Abeykoon, Eric Dooryhee, Aleksandra Tomic, Yanan Huang, John B. Warren, Emil S. Bozin, Simon J. L. Billinge, Yuping Sun, Yimei Zhu, Gabriel Kotliar, and Cedomir Petrovic,
npj Quantum Materials 2, Article number: 11 (2017)

Universality classes of order parameters composed of many-body bound states

A. M. Tsvelik,
Phys. Rev. B 94, 205141 (2016)

Accelerating DMFT- MatDeLab GW Calculation with GPU

Zhihua Dong, Kwangmin Yu, Sangkook Choi, and Nicholas D’Imperio,
The International Conference for High Performance Computing, Networking, Storage and Analysis (2016)

Electronic structure of Na, K, Si, and LiF from self-consistent solution of Hedin's equations including vertex corrections

Andrey L. Kutepov,
Phys. Rev. B 94, 155101 (2016)

First-principles treatment of Mott insulators: linearized QSGW+DMFT approach

Sangkook Choi, Andrey Kutepov, Kristjan Haule, Mark van Schilfgaarde, and Gabriel Kotliar,
Quantum Materials 1, 16001 (2016)