J. J. Rehr

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All published works

Action	Title	Year	Authors
+	Time-Resolved X-Ray Spectroscopy from the Atomic Orbital Ground State Up	2025	Daniel Jost Eder G. Lomeli Ta Tang J. J. Kas J. J. Rehr Wei-Sheng Lee Hong‐Chen Jiang Brian Moritz Thomas Devereaux
+ PDF Chat	Capturing many-body correlation effects with quantum and classical computing	2024	Karol Kowalski Nicholas P. Bauman Guang Hao Low Martin Roetteler J. J. Rehr Fernando D. Vila
+ PDF Chat	Exploring the exact limits of the real-time equation-of-motion coupled cluster cumulant Green’s functions	2024	Bo Peng Himadri Pathak Ajay Panyala Fernando D. Vila J. J. Rehr Karol Kowalski
+ PDF Chat	On the exact limit of the time-dependent coupled cluster ansatz and its approximations in the real-time equation-of-motion coupled cluster cumulant Green's function approach	2024	Bo Peng Himadri Pathak Ajay Panyala Fernando D. Vila J. J. Rehr Karol Kowalski
+ PDF Chat	Time-resolved X-ray Spectroscopy from the Atomic Orbital Ground State Up	2024	Daniel Jost Eder G. Lomeli Ta Tang J. J. Kas J. J. Rehr Wei-Sheng Lee Hong‐Chen Jiang Brian Moritz Thomas Devereaux
+ PDF Chat	Capturing many-body correlation effects with quantum and classical computing	2024	Karol Kowalski Nicholas P. Bauman Guang Hao Low Martin Roetteler J. J. Rehr Fernando D. Vila
+ PDF Chat	Core-to-core X-ray emission spectra from Wannier based multiplet ligand field theory	2024	Charles A. Cardot J. J. Kas Jared E. Abramson J. J. Rehr Gerald T. Seidler
+ PDF Chat	Real-Time Equation-of-Motion Coupled-Cluster Cumulant Green’s Function Method: Heterogeneous Parallel Implementation Based on the Tensor Algebra for Many-Body Methods Infrastructure	2023	Himadri Pathak Ajay Panyala Bo Peng Nicholas P. Bauman Erdal Mutlu J. J. Rehr Fernando D. Vila Karol Kowalski
+	High-temperature self-energy corrections to x-ray absorption spectra	2023	Tun S. Tan J. J. Kas S. B. Trickey J. J. Rehr
+ PDF Chat	Real-space Green's function approach for intrinsic losses in x-ray spectra	2023	J. J. Kas J. J. Rehr
+	Real-time Equation-of-Motion Coupled-Cluster Cumulant Green's Function Method: Heterogeneous Parallel Implementation Based on the Tensor Algebra for Many-body Methods Infrastructure	2023	Himadri Pathak Ajay Panyala Bo Peng Nicholas P. Bauman Erdal Mutlu J. J. Rehr Fernando D. Vila Karol Kowalski
+	Core-to-Core X-ray Emission Spectra from Wannier Based Multiplet Ligand Field Theory	2023	Charles Cardot J. J. Kas Jared E. Abramson J. J. Rehr Gerald T. Seidler
+ PDF Chat	Core-to-Core X-Ray Emission Spectra from Wannier Based Multiplet Ligand Field Theory	2023	Charles A. Cardot J. J. Kas Jared E. Abramson J. J. Rehr Gerald T. Seidler
+ PDF Chat	Real-time equation-of-motion CC cumulant and CC Green’s function simulations of photoemission spectra of water and water dimer	2022	Fernando D. Vila J. J. Rehr Himadri Pathak Bo Peng Ajay Panyala Erdal Mutlu Nicholas P. Bauman Karol Kowalski
+	<i>Ab Initio</i>Multiplet-Plus-Cumulant Approach for Correlation Effects in X-Ray Photoelectron Spectroscopy	2022	J. J. Kas J. J. Rehr Thomas Devereaux
+ PDF Chat	Full spectrum optical constant interface to the Materials Project	2021	J. J. Kas Fernando D. Vila C. D. Pemmaraju Micah P. Prange Kristin A. Persson Ruoxi Yang J. J. Rehr
+	Web-based methods for X-ray and photoelectron spectroscopies	2021	Thomas Devereaux Brian Moritz Chunjing Jia J. J. Kas J. J. Rehr
+ PDF Chat	Real-space Green's function approach for x-ray spectra at high temperature	2021	Tun S. Tan J. J. Kas J. J. Rehr
+	Combined multiplet and cumulant Green's function treatment of correlation effects in x-ray photoelectron spectroscopy	2021	J. J. Kas J. J. Rehr T. P. Devereaux
+	Advanced calculations of x-ray spectroscopies with FEFF10 and Corvus	2021	J. J. Kas Fernando D. Vila J. J. Rehr C. D. Pemmaraju Tun S. Tan
+	Full spectrum optical constant interface to the Materials Project	2021	J. J. Kas Fernando D. Vila C. D. Pemmaraju Micah P. Prange Kristin A. Persson Runling Yang J. J. Rehr
+ PDF Chat	Real-Time Coupled-Cluster Approach for the Cumulant Green’s Function	2020	Fernando D. Vila J. J. Rehr J. J. Kas Karol Kowalski Bo Peng
+ PDF Chat	Nonlinear response in the cumulant expansion for core-level photoemission	2020	Marilena Tzavala J. J. Kas Lucia Reining J. J. Rehr
+ PDF Chat	Equation of motion coupled-cluster cumulant approach for intrinsic losses in x-ray spectra	2020	J. J. Rehr Fernando D. Vila J. J. Kas N. Y. Hirshberg Karol Kowalski Bo Peng
+	Velocity-gauge real-time TDDFT within a numerical atomic orbital basis set	2018	C. D. Pemmaraju Fernando D. Vila J. J. Kas Shunsuke A. Sato J. J. Rehr Kazuhiro Yabana David Prendergast
+ PDF Chat	Cumulant Green's function calculations of plasmon satellites in bulk sodium: Influence of screening and the crystal environment	2018	Jianqiang Sky Zhou Matteo Gatti J. J. Kas J. J. Rehr Lucia Reining
+	Dispersing and non-dispersing satellites in the photoemission spectra of aluminum	2018	Jianqiang Sky Zhou Lucia Reining Alessandro Nicolaou Azzedine Bendounan Kari Ruotsalainen M. Vanzini J. J. Kas J. J. Rehr Matthias Muntwiler Vladimir N. Strocov
+ PDF Chat	Finite Temperature Green’s Function Approach for Excited State and Thermodynamic Properties of Cool to Warm Dense Matter	2017	J. J. Kas J. J. Rehr
+	Automated Generation and Ensemble-Learned Matching of X-ray Absorption Spectra	2017	Zheng Chen Kiran Mathew Chi Chen Yiming Chen Hanmei Tang Alan Dozier J. J. Kas Fernando D. Vila J. J. Rehr Louis F. J. Piper
+ PDF Chat	Particle-hole cumulant approach for inelastic losses in x-ray spectra	2016	J. J. Kas J. J. Rehr J. B. Curtis
+ PDF Chat	Efficient implementation of core-excitation Bethe–Salpeter equation calculations	2015	Keith Gilmore John Vinson Eric L. Shirley David Prendergast C. D. Pemmaraju J. J. Kas Fernando D. Vila J. J. Rehr
+	Large-scale core-level Bethe-Salpeter equation calculations	2015	Keith Gilmore John Vinson Eric L. Shirley David Prendergast C. D. Pemmaraju J. J. Kas J. J. Rehr Fernando D. Vila
+ PDF Chat	Real-time cumulant approach for charge-transfer satellites in x-ray photoemission spectra	2015	J. J. Kas Fernando D. Vila J. J. Rehr S. A. Chambers
+	Applications of the Retarded Cumulant Expansion to Realistic Systems	2015	J. J. Kas J. J. Rehr
+ PDF Chat	Cumulant expansion for phonon contributions to the electron spectral function	2014	S. M. Story J. J. Kas Fernando D. Vila Matthieu J. Verstraete J. J. Rehr
+ PDF Chat	Correlation dynamics and enhanced signals for the identification of serial biomolecules and DNA bases	2014	Towfiq Ahmed J. T. Haraldsen J. J. Rehr Massimiliano Di Ventra Iván K. Schuller Alexander V. Balatsky
+ PDF Chat	Charge transfer satellites in x-ray spectra of transition metal oxides	2014	Egor Klevak J. J. Kas J. J. Rehr
+ PDF Chat	Accuracy of generalized gradient approximation functionals for density-functional perturbation theory calculations	2014	Lianhua He Fang Liu Geoffroy Hautier Micael J. T. Oliveira Miguel A. L. Marques Fernando D. Vila J. J. Rehr Gian‐Marco Rignanese Aihui Zhou
+	Generalized particle/hole cumulant approximation for the electron Green's function	2014	J. J. Kas J. J. Rehr Lucia Reining
+	Shake-Rattle-and-Roll: A Model of Dynamic Structural Disorder in Supported Nanoscale Catalysts	2013	J. J. Rehr Fernando D. Vila
+ PDF Chat	A high performance scientific cloud computing environment for materials simulations	2012	Kevin Jorissen Fernando D. Vila J. J. Rehr
+ PDF Chat	X-ray absorption Debye-Waller factors from<i>ab initio</i>molecular dynamics	2012	Fernando D. Vila V. E. Lindahl J. J. Rehr
+ PDF Chat	Theoretical optical and x-ray spectra of liquid and solid H<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:msub><mml:mrow /><mml:mn>2</mml:mn></mml:msub></mml:math>O	2012	John Vinson J. J. Kas Fernando D. Vila J. J. Rehr Eric L. Shirley
+ PDF Chat	Valence Electron Photoemission Spectrum of Semiconductors:<i>Ab Initio</i>Description of Multiple Satellites	2011	Matteo Guzzo Giovanna Lani Francesco Sottile Pina Romaniello Matteo Gatti J. J. Kas J. J. Rehr Mathieu G. Silly Fausto Sirotti Lucia Reining
+	Real-space Green's Function Calculations including Hubbard Contributions	2011	Towfiq Ahmed J. J. Kas J. J. Rehr
+ PDF Chat	X-ray absorption near-edge spectra of overdopedLa2−xSrxCuO4high-Tcsuperconductors	2011	Towfiq Ahmed Tanmoy Das J. J. Kas Hsin Lin B. Barbiellini Fernando D. Vila R. S. Markiewicz Arun Bansil J. J. Rehr
+ PDF Chat	Bethe-Salpeter equation calculations of core excitation spectra	2011	John Vinson J. J. Rehr J. J. Kas Eric L. Shirley
+	Real Space Green's Function Approach to RIXS	2011	J. J. Kas J. J. Rehr J. A. Soininen Pieter Glatzel
+	GW+U real-space Green's function calculations of x-ray spectra	2011	Towfiq Ahmed J. J. Kas J. J. Rehr
+ PDF Chat	<i>Ab initio</i>analysis of the x-ray absorption spectrum of the myoglobin–carbon monoxide complex: Structure and vibrations	2010	Giulia Veronesi C. Degli Esposti Boschi L. Ferrari Giovanni Venturoli F. Boscherini Fernando D. Vila J. J. Rehr
+ PDF Chat	Basis set effects on the hyperpolarizability of CHCl3: Gaussian-type orbitals, numerical basis sets and real-space grids	2010	Fernando D. Vila David A. Strubbe Y. Takimoto Xavier Andrade Ángel Rubio Steven G. Louie J. J. Rehr
+	Scientific Computing in the Cloud	2010	J. J. Rehr Fernando D. Vila Jeffrey J. Gardner L. Svec Micah P. Prange
+	Phase Space Wannier Functions in Electronic Structure Calculations	2010	D. J. Sullivan J. J. Rehr John W. Wilkins Kenneth G. Wilson
+ PDF Chat	Real space calculation of optical constants from optical to x-ray frequencies	2009	Micah P. Prange J. J. Rehr G. Rivas J. J. Kas John W. Lawson
+	Scientific Computing in the Cloud	2009	J. J. Rehr Jonathan P. Gardner Micah P. Prange L. Svec Fernando D. Vila
+ PDF Chat	Optical to UV spectra and birefringence of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mtext>SiO</mml:mtext></mml:mrow><mml:mn>2</mml:mn></mml:msub></mml:mrow></mml:math>and<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mtext>TiO</mml:mtext></mml:mrow><mml:mn>2</mml:mn></mml:msub></mml:mrow></mml:math>: First-principles calculations with excitonic effects	2008	Hadley M. Lawler J. J. Rehr Fernando D. Vila Sergio D. Dalosto Eric L. Shirley Zachary H. Levine
+ PDF Chat	The local electronic structure of α-Li3N	2008	T. T. Fister Gerald T. Seidler Eric L. Shirley Fernando D. Vila J. J. Rehr K. P. Nagle John C. Linehan J. O. Cross
+ PDF Chat	Exciton spectroscopy of hexagonal boron nitride using nonresonant x-ray Raman scattering	2008	Yejun Feng J. A. Soininen A. L. Ankudinov J. O. Cross Gerald T. Seidler A. T. Macrander J. J. Rehr Eric L. Shirley
+ PDF Chat	Magic angle in electron energy loss spectra: Relativistic and dielectric corrections	2008	A. P. Sorini J. J. Rehr Zachary H. Levine
+	Dynamic structure in Pt nanoclusters on $\gamma$-alumina	2008	Floran Vila J. J. Rehr Josef A. Käs Ralph G. Nuzzo Anatoly I. Frenkel
+	Intermediate-Range Order in Water Ices	2008	T. T. Fister K. P. Nagle Fernando D. Vila Gerald T. Seidler Chris Hamner J. O. Cross J. J. Rehr
+ PDF Chat	Many-pole model of inelastic losses in x-ray absorption spectra	2007	J. J. Kas A. P. Sorini Micah P. Prange L. W. Cambell J. A. Soininen J. J. Rehr
+ PDF Chat	Theoretical x-ray absorption Debye-Waller factors	2007	Fernando D. Vila J. J. Rehr H. Rossner H. J. Krappe
+ PDF Chat	Deconvolving instrumental and intrinsic broadening in core-shell x-ray spectroscopies	2007	T. T. Fister Gerald T. Seidler J. J. Rehr J. J. Kas W. T. Elam J. O. Cross K. P. Nagle
+	Real Space Multiple Scattering Calculations of Relativistic Electron Energy Loss Spectra	2007	Kevin Jorissen J. J. Rehr
+ PDF Chat	Background proportional enhancement of the extended fine structure in nonresonant inelastic x-ray scattering	2006	T. T. Fister Gerald T. Seidler Chris Hamner J. O. Cross J. A. Soininen J. J. Rehr
+ PDF Chat	<i>Ab initio</i>calculations of electron inelastic mean free paths and stopping powers	2006	A. P. Sorini J. J. Kas J. J. Rehr Micah P. Prange Zachary H. Levine
+ PDF Chat	Resonance anomalous surface X-ray scattering	2006	Andreas Menzel Kee‐Chul Chang Vladimír Komanický Hoydoo You Yong S. Chu Yuriy V. Tolmachev J. J. Rehr
+ PDF Chat	Polarization-dependent resonant anomalous surface X-ray scattering of CO/Pt(111)	2006	Andreas Menzel Yuriy V. Tolmachev Kee‐Chul Chang Vladimír Komanický Yaoqing Chu J. J. Rehr Hoydoo You
+	Ab initio calculations of inelastic losses and optical constants	2006	J. J. Rehr J. J. Kas Micah P. Prange Fernando D. Vila Luke W. Campbell A. P. Sorini
+ PDF Chat	Local environment of nitrogen in GaNyAs1−y epilayers on GaAs (001) studied using X-ray absorption near edge spectroscopy	2005	J. A. Gupta M. W. C. Dharma‐wardana Astrid Jürgensen E. D. Crozier J. J. Rehr Micah P. Prange
+ PDF Chat	Inelastic scattering from core electrons: A multiple scattering approach	2005	J. A. Soininen A. L. Ankudinov J. J. Rehr
+	Dynamic screening in L_2,3-shell transition metal x-ray absorption	2002	A. L. Ankudinov Alexey I. Nesvizhskii J. J. Rehr
+	Interference between Extrinsic and Intrinsic Losses in XAFS	2001	L. Campbell Lars Hedin J. J. Rehr W. Bardyszewski
+ PDF Chat	Effect of Screening on Thermonuclear Fusion in Stellar and Laboratory Plasmas	2000	L. Wilets B. G. Giraud Mitchell J. Watrous J. J. Rehr
+ PDF Chat	X-ray-absorption fine structure in embedded atoms	1994	J. J. Rehr Corwin H. Booth F. Bridges S. I. Zabinsky
+	Critical Properties of the Void Percolation Problem for Spheres	1984	W. T. Elam Alan R. Kerstein J. J. Rehr
+	A note on the percolation probabilities of pairs of closely similar lattices	1974	M F Sykes J. J. Rehr M Glen
+	Coexistence curve properties of Mermin's decorated lattice gas	1974	George W. Mulholland J. J. Rehr

Common Coauthors

Coauthor	Papers Together
J. J. Kas	38
Fernando D. Vila	33
Micah P. Prange	9
Karol Kowalski	9
Gerald T. Seidler	8
Eric L. Shirley	7
Bo Peng	6
C. D. Pemmaraju	6
Lucia Reining	5
Nicholas P. Bauman	5
Ajay Panyala	5
Himadri Pathak	5
J. O. Cross	5
J. A. Soininen	5
John Vinson	4
T. T. Fister	4
J. J. Kas	4
A. P. Sorini	4
Thomas Devereaux	4
Towfiq Ahmed	4
K. P. Nagle	3
Zachary H. Levine	3
A. L. Ankudinov	3
Erdal Mutlu	3
Tun S. Tan	3
Jared E. Abramson	3
David Prendergast	3
Matteo Gatti	3
Brian Moritz	3
Kristin A. Persson	3
Chris Hamner	2
Daniel Jost	2
Keith Gilmore	2
Kevin Jorissen	2
Eder G. Lomeli	2
W. T. Elam	2
Hong‐Chen Jiang	2
L. Svec	2
Hoydoo You	2
Guang Hao Low	2
Fausto Sirotti	2
Kee‐Chul Chang	2
Ta Tang	2
Yuriy V. Tolmachev	2
Jianqiang Sky Zhou	2
Vladimír Komanický	2
Andreas Menzel	2
Martin Roetteler	2
Wei-Sheng Lee	2
Charles A. Cardot	2

Commonly Cited References

Action	Title	Year	Authors	# of times referenced
+ PDF Chat	Real-time cumulant approach for charge-transfer satellites in x-ray photoemission spectra	2015	J. J. Kas Fernando D. Vila J. J. Rehr S. A. Chambers	9
+ PDF Chat	Valence Electron Photoemission Spectrum of Semiconductors:<i>Ab Initio</i>Description of Multiple Satellites	2011	Matteo Guzzo Giovanna Lani Francesco Sottile Pina Romaniello Matteo Gatti J. J. Kas J. J. Rehr Mathieu G. Silly Fausto Sirotti Lucia Reining	9
+ PDF Chat	Many-pole model of inelastic losses in x-ray absorption spectra	2007	J. J. Kas A. P. Sorini Micah P. Prange L. W. Cambell J. A. Soininen J. J. Rehr	8
+ PDF Chat	Optical to UV spectra and birefringence of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mtext>SiO</mml:mtext></mml:mrow><mml:mn>2</mml:mn></mml:msub></mml:mrow></mml:math>and<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mtext>TiO</mml:mtext></mml:mrow><mml:mn>2</mml:mn></mml:msub></mml:mrow></mml:math>: First-principles calculations with excitonic effects	2008	Hadley M. Lawler J. J. Rehr Fernando D. Vila Sergio D. Dalosto Eric L. Shirley Zachary H. Levine	8
+ PDF Chat	Theoretical x-ray absorption Debye-Waller factors	2007	Fernando D. Vila J. J. Rehr H. Rossner H. J. Krappe	8
+ PDF Chat	Bethe-Salpeter equation calculations of core excitation spectra	2011	John Vinson J. J. Rehr J. J. Kas Eric L. Shirley	8
+ PDF Chat	Equation of motion coupled-cluster cumulant approach for intrinsic losses in x-ray spectra	2020	J. J. Rehr Fernando D. Vila J. J. Kas N. Y. Hirshberg Karol Kowalski Bo Peng	8
+ PDF Chat	Particle-hole cumulant approach for inelastic losses in x-ray spectra	2016	J. J. Kas J. J. Rehr J. B. Curtis	7
+ PDF Chat	Multiplet ligand-field theory using Wannier orbitals	2012	M. W. Haverkort M. Zwierzycki O. K. Andersen	6
+ PDF Chat	The SIESTA method for<i>ab initio</i>order-<i>N</i>materials simulation	2002	José M. Soler Emilio Artacho Julian D. Gale Alberto Garcı́a Javier Junquera Pablo Ordejón Daniel Sánchez‐Portal	6
+ PDF Chat	Charge transfer satellites in x-ray spectra of transition metal oxides	2014	Egor Klevak J. J. Kas J. J. Rehr	5
+ PDF Chat	Communication: Time-dependent optimized coupled-cluster method for multielectron dynamics	2018	Takeshi Sato Himadri Pathak Yuki Orimo Kenichi L. Ishikawa	5
+ PDF Chat	Real-Time Coupled-Cluster Approach for the Cumulant Green’s Function	2020	Fernando D. Vila J. J. Rehr J. J. Kas Karol Kowalski Bo Peng	5
+ PDF Chat	Inelastic scattering from core electrons: A multiple scattering approach	2005	J. A. Soininen A. L. Ankudinov J. J. Rehr	5
+ PDF Chat	Physical Origin of Satellites in Photoemission of Doped Graphene: An<i>Ab Initio</i><mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>G</mml:mi><mml:mi>W</mml:mi></mml:math>Plus Cumulant Study	2013	Johannes Lischner Derek Vigil‐Fowler Steven G. Louie	5
+ PDF Chat	Transition from the adiabatic to the sudden limit in core-level photoemission: A model study of a localized system	1999	J. D. Lee O. Gunnarsson Lars Hedin	5
+ PDF Chat	Phonons and related crystal properties from density-functional perturbation theory	2001	Stefano Baroni Stefano de Gironcoli Andrea Dal Corso Paolo Giannozzi	5
+ PDF Chat	Time-dependent coupled-cluster method for atomic nuclei	2012	D. A. Pigg G. Hagen Hai Ah Nam T. Papenbrock	4
+ PDF Chat	K-edge x-ray absorption spectra in transition-metal oxides beyond the single-particle approximation: Shake-up many-body effects	2012	Matteo Calandra Jean‐Pascal Rueff Christos Gougoussis D. Céolin Mihaela Gorgoi Stefania Benedetti Piero Torelli Abhay Shukla D. Chandesris Christian Brouder	4
+ PDF Chat	On the Relation between Equation-of-Motion Coupled-Cluster Theory and the <i>GW</i> Approximation	2018	Malte F. Lange Timothy C. Berkelbach	4
+ PDF Chat	Real space calculation of optical constants from optical to x-ray frequencies	2009	Micah P. Prange J. J. Rehr G. Rivas J. J. Kas John W. Lawson	4
+ PDF Chat	Dynamical screening effects in correlated materials: Plasmon satellites and spectral weight transfers from a Green's function ansatz to extended dynamical mean field theory	2012	Michele Casula A. N. Rubtsov Silke Biermann	4
+ PDF Chat	A Time-Dependent Formulation of Coupled-Cluster Theory for Many-Fermion Systems at Finite Temperature	2018	Alec F. White Garnet Kin‐Lic Chan	4
+ PDF Chat	Projector augmented-wave method	1994	Peter E. Blöchl	3
+ PDF Chat	yambo: An ab initio tool for excited state calculations	2009	Andrea Marini Conor Hogan Myrta Grüning Daniele Varsano	3
+ PDF Chat	Background proportional enhancement of the extended fine structure in nonresonant inelastic x-ray scattering	2006	T. T. Fister Gerald T. Seidler Chris Hamner J. O. Cross J. A. Soininen J. J. Rehr	3
+ PDF Chat	Accurate Homogeneous Electron Gas Exchange-Correlation Free Energy for Local Spin-Density Calculations	2014	Valentin V. Karasiev Travis Sjostrom James W. Dufty S. B. Trickey	3
+ PDF Chat	Spectral functions of the uniform electron gas via coupled-cluster theory and comparison to the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:mi>G</mml:mi><mml:mi>W</mml:mi></mml:mrow></mml:math>and related approximations	2016	James McClain Johannes Lischner Thomas J. Watson Devin A. Matthews Enrico Ronca Steven G. Louie Timothy C. Berkelbach Garnet Kin‐Lic Chan	3
+ PDF Chat	QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials	2009	Paolo Giannozzi Stefano Baroni Nicola Bonini Matteo Calandra Roberto Car Carlo Cavazzoni Davide Ceresoli G. Chiarotti Matteo Cococcioni Ismaïla Dabo	3
+ PDF Chat	<i>Ab initio</i>calculations of electron inelastic mean free paths and stopping powers	2006	A. P. Sorini J. J. Kas J. J. Rehr Micah P. Prange Zachary H. Levine	3
+ PDF Chat	Nonlinear response in the cumulant expansion for core-level photoemission	2020	Marilena Tzavala J. J. Kas Lucia Reining J. J. Rehr	3
+ PDF Chat	Approximate Green’s Function Coupled Cluster Method Employing Effective Dimension Reduction	2019	Bo Peng Roel Van Beeumen David B. Williams‐Young Karol Kowalski Chao Yang	3
+ PDF Chat	Coupled Cluster as an Impurity Solver for Green’s Function Embedding Methods	2019	Avijit Shee Dominika Zgid	3
+ PDF Chat	Finite Temperature Green’s Function Approach for Excited State and Thermodynamic Properties of Cool to Warm Dense Matter	2017	J. J. Kas J. J. Rehr	3
+ PDF Chat	On the combined use of GW approximation and cumulant expansion in the calculations of quasiparticle spectra: The paradigm of Si valence bands	2016	B. Gumhalter Vjekoslav Kovač Fabio Caruso Henry Lambert Feliciano Giustino	3
+ PDF Chat	Anomalous charge and negative-charge-transfer insulating state in cuprate chain compound<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:msub><mml:mi>KCuO</mml:mi><mml:mn>2</mml:mn></mml:msub></mml:math>	2015	Debraj Choudhury Pablo Rivero D. Meyers X. Liu Yanwei Cao S. Middey M. J. Whitaker Salvador Barraza‐Lopez J. W. Freeland M. Greenblatt	2
+	A practical method for numerical evaluation of solutions of partial differential equations of the heat-conduction type	1947	J Crank P. Nicolson	2
+ PDF Chat	Time-dependent complete-active-space self-consistent-field method for multielectron dynamics in intense laser fields	2013	Takeshi Sato Kenichi L. Ishikawa	2
+	<i>Ab initio</i><mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:mi>G</mml:mi><mml:mi>W</mml:mi></mml:mrow></mml:math>plus cumulant calculation for isolated band systems: Application to organic conductor<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:msub><mml:mrow><mml:mo>(</mml:mo><mml:mi mathvariant="normal">TMTSF</mml:mi><mml:mo>)</mml:mo></mml:mrow><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mi>PF</mml:mi><mml:mn>6</mml:mn></mml:msub></mml:…	2016	Kazuma Nakamura Yoshiro Nohara Yoshihide Yosimoto Yusuke Nomura	2
+ PDF Chat	Quasiparticle Self-Consistent<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>G</mml:mi><mml:mi>W</mml:mi></mml:math>Theory	2006	Mark van Schilfgaarde Takao Kotani Sergey V. Faleev	2
+ PDF Chat	Linear-Scaling ab-initio Calculations for Large and Complex Systems	1999	Emilio Artacho Daniel Sánchez‐Portal Pablo Ordej�n A. Garc�a José M. Soler	2
+ PDF Chat	Exciton-Plasmon States in Nanoscale Materials: Breakdown of the Tamm−Dancoff Approximation	2009	Myrta Grüning Andrea Marini Xavier Gonze	2
+ PDF Chat	Electronic structure calculations with dynamical mean-field theory	2006	Gabriel Kotliar Sergey Y. Savrasov Kristjan Haule V. S. Oudovenko Olivier Parcollet Chris A. Marianetti	2
+ PDF Chat	Importance of finite-temperature exchange correlation for warm dense matter calculations	2016	Valentin V. Karasiev Lázaro Calderín S. B. Trickey	2
+ PDF Chat	Spectral fingerprints of electron-plasmon coupling	2015	Fabio Caruso Feliciano Giustino	2
+ PDF Chat	Basis set effects on the hyperpolarizability of CHCl3: Gaussian-type orbitals, numerical basis sets and real-space grids	2010	Fernando D. Vila David A. Strubbe Y. Takimoto Xavier Andrade Ángel Rubio Steven G. Louie J. J. Rehr	2
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