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All published works
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Title
Year
Authors
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Allegro-Legato: Scalable, Fast, and Robust Neural-Network Quantum Molecular Dynamics via Sharpness-Aware Minimization
2023
Hikaru Ibayashi
Taufeq Mohammed Razakh
Liqiu Yang
Thomas Linker
Marco Olguin
Shinnosuke Hattori
Ye Luo
Rajiv K. Kalia
Aiichiro Nakano
Ken‐ichi Nomura
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PDF
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A High-Performance Design for Hierarchical Parallelism in the QMCPACK Monte Carlo code
2022
Ye Luo
Peter Doak
Paul R. C. Kent
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PDF
Chat
Estimation and inference of treatment effects with L2-boosting in high-dimensional settings
2022
Jannis Kueck
Ye Luo
Martin Spindler
Zigan Wang
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Estimation and Inference Methods for Sorted Causal Effects and Classification Analysis [R package SortedEffects version 1.6.0]
2021
Shuowen Chen
Victor Chernozhukov
Iván Fernández‐Val
Ye Luo
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Self-fulfilling Bandits: Endogeneity Spillover and Dynamic Selection in Algorithmic Decision-making.
2021
Jin Li
Ye Luo
Xiaowei Zhang
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Self-fulfilling Bandits: Dynamic Selection in Algorithmic Decision-making
2021
Jin Li
Ye Luo
Xiaowei Zhang
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PDF
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Errors in the Dependent Variable of Quantile Regression Models
2021
Jerry A. Hausman
Haoyang Liu
Ye Luo
Christopher Palmer
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Causal Reinforcement Learning: An Instrumental Variable Approach
2021
Jin Li
Ye Luo
Xiaowei Zhang
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PDF
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Causal Reinforcement Learning: An Instrumental Variable Approach
2021
Jin Li
Ye Luo
Xiaowei Zhang
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Dynamic Selection in Algorithmic Decision-making
2021
Jin Li
Ye Luo
Xiaowei Zhang
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Shape-Enforcing Operators for Generic Point and Interval Estimators of Functions
2021
Xi Chen
Victor Chernozhukov
Iván Fernández‐Val
Scott Kostyshak
Ye Luo
+
Self-fulfilling Bandits: Endogeneity Spillover and Dynamic Selection in Algorithmic Decision-making
2021
Jin Li
Ye Luo
Xiaowei Zhang
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Toward a systematic improvement of the fixed-node approximation in diffusion Monte Carlo for solids—A case study in diamond
2020
Anouar Benali
Kevin Gasperich
Kenneth D. Jordan
Thomas Applencourt
Ye Luo
M. Chandler Bennett
Jaron T. Krogel
Luke Shulenburger
Paul R. C. Kent
Pierre‐François Loos
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Towards a Systematic Improvement of the Fixed-Node Approximation in Diffusion Monte Carlo for Solids
2020
Anouar Benali
Kevin Gasperich
Kenneth D. Jordan
Thomas Applencourt
Ye Luo
M. Chandler Bennett
Jaron T. Krogel
Luke Shulenburger
Paul R. C. Kent
Pierre‐François Loos
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Towards a Systematic Improvement of the Fixed-Node Approximation in Diffusion Monte Carlo for Solids -- A Case Study In Diamond
2020
Anouar Benali
Kevin Gasperich
Kenneth D. Jordan
Thomas Applencourt
Ye Luo
M. Chandler Bennett
Jaron T. Krogel
Luke Shulenburger
Paul R. C. Kent
Pierre‐François Loos
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PDF
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<scp>TurboRVB</scp>: A many-body toolkit for <i>ab initio</i> electronic simulations by quantum Monte Carlo
2020
Kousuke Nakano
Claudio Attaccalite
Matteo Barborini
Luca Capriotti
Michele Casula
Emanuele Coccia
Mario Dagrada
Claudio Genovese
Ye Luo
Guglielmo Mazzola
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PDF
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QMCPACK: Advances in the development, efficiency, and application of auxiliary field and real-space variational and diffusion quantum Monte Carlo
2020
Paul R. C. Kent
Abdulgani Annaberdiyev
Anouar Benali
M. Chandler Bennett
Edgar Josué Landinez Borda
Peter Doak
Hongxia Hao
Kenneth D. Jordan
Jaron T. Krogel
Ilkka Kylänpää
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Estimation and Inference Methods for Sorted Causal Effects and Classification Analysis [R package SortedEffects version 1.2.0]
2020
Shuowen Chen
Victor Chernozhukov
Iván Fernández‐Val
Ye Luo
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PDF
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Exascale applications: skin in the game
2020
Francis J. Alexander
Ann Almgren
John B. Bell
A. Bhattacharjee
Jacqueline Chen
Phil Colella
David Daniel
Jack Deslippe
Lori Freitag Diachin
Erik W. Draeger
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PDF
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SortedEffects: Sorted Causal Effects in R
2020
Shuowen Chen
Victor Chernozhukov
Iván Fernández‐Val
Ye Luo
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Shape-enforcing operators for point and interval estimators
2019
Iván Fernández‐Val
Xi Chen
Victor Chernozhukov
Scott Kostyshak
Ye Luo
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Replication data for: Core Determining Class and Inequality Selection
2019
Ye Luo
Hai Wang
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SortedEffects: Sorted Causal Effects in R
2019
Shuowen Chen
Victor Chernozhukov
Iván Fernández‐Val
Ye Luo
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PDF
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Diffusion Monte Carlo study of <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:msub><mml:mi mathvariant="normal">O</mml:mi><mml:mn>2</mml:mn></mml:msub></mml:math> adsorption on single layer graphene
2019
Hyeondeok Shin
Ye Luo
Anouar Benali
Yongkyung Kwon
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SortedEffects: Estimation and Inference Methods for Sorted Causal Effects and Classification Analysis
2019
Shuowen Chen
Victor Chernozhukov
Iván Fernández‐Val
Ye Luo
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Adaptive Discrete Smoothing for High-Dimensional and Nonlinear Panel Data
2019
Xi Chen
Victor Chernozhukov
Ye Luo
Martin Spindler
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SortedEffects: Sorted Causal Effects in R
2019
Shuowen Chen
Victor Chernozhukov
Iván Fernández‐Val
Ye Luo
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A Blockwise Consistency Method for Parameter Estimation of Complex Models
2018
Runmin Shi
Faming Liang
Qifan Song
Ye Luo
Malay Ghosh
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An efficient hybrid orbital representation for quantum Monte Carlo calculations
2018
Ye Luo
K. Esler
Paul R. C. Kent
Luke Shulenburger
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Zirconia and hafnia polymorphs: Ground-state structural properties from diffusion Monte Carlo
2018
Hyeondeok Shin
Anouar Benali
Ye Luo
Emily Crabb
Alejandro López‐Bezanilla
Laura E. Ratcliff
Andrea Jokisaari
Olle Heinonen
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An Imputation–Regularized Optimization Algorithm for High Dimensional Missing Data Problems and Beyond
2018
Faming Liang
Bochao Jia
Jingnan Xue
Qizhai Li
Ye Luo
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PDF
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<tt>QMCPACK</tt>: an open source<i>ab initio</i>quantum Monte Carlo package for the electronic structure of atoms, molecules and solids
2018
Jeongnim Kim
Andrew Baczewski
Todd D. Beaudet
Anouar Benali
M. Chandler Bennett
M. Berrill
Nick S. Blunt
Edgar Josué Landinez Borda
Michele Casula
David M. Ceperley
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PDF
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The Sorted Effects Method: Discovering Heterogeneous Effects Beyond Their Averages
2018
Victor Chernozhukov
Iván Fernández‐Val
Ye Luo
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An Imputation-Consistency Algorithm for High-Dimensional Missing Data Problems and Beyond
2018
Faming Liang
Bochao Jia
Jingnan Xue
Qizhai Li
Ye Luo
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Identifying and Computing the Exact Core-determining Class
2018
Ye Luo
Hai Wang
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Estimation and Inference of Treatment Effects with $L_2$-Boosting in High-Dimensional Settings
2018
Jannis Kueck
Ye Luo
Martin Spindler
Zigan Wang
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Embracing a new era of highly efficient and productive quantum Monte Carlo simulations
2017
Amrita Mathuriya
Ye Luo
Raymond C. Clay
Anouar Benali
Luke Shulenburger
Jeongnim Kim
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Zirconia and its allotropes -- a Quantum Monte Carlo study
2017
Anouar Benali
Hyeondeok Shin
Ye Luo
Alejandro López‐Bezanilla
Laura E. Ratcliff
Andrea Jokisaari
Olle Heinonen
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Optimization and Parallelization of B-Spline Based Orbital Evaluations in QMC on Multi/Many-Core Shared Memory Processors
2017
Amrita Mathuriya
Ye Luo
Anouar Benali
Luke Shulenburger
Jeongnim Kim
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<i>L</i><sub>2</sub>-Boosting for Economic Applications
2017
Ye Luo
Martin Spindler
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$L_2$Boosting for Economic Applications
2017
Ye Luo
Martin Spindler
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$L_2$Boosting for Economic Applications
2017
Ye Luo
Martin Spindler
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PDF
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Phase stability of TiO<sub>2</sub>polymorphs from diffusion Quantum Monte Carlo
2016
Ye Luo
Anouar Benali
Luke Shulenburger
Jaron T. Krogel
Olle Heinonen
Paul R. C. Kent
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$L_2$Boosting in High-Dimensions: Rate of Convergence.
2016
Ye Luo
Martin Spindler
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High-Dimensional $L_2$Boosting: Rate of Convergence
2016
Ye Luo
Martin Spindler
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The sorted effects method: discovering heterogeneous effects beyond their averages
2015
Iván Fernández‐Val
Ye Luo
Victor Chernozhukov
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PDF
Chat
<i> <i>Ab initio</i> </i> molecular dynamics simulation of liquid water by quantum Monte Carlo
2015
Andrea Zen
Ye Luo
Guglielmo Mazzola
Leonardo Guidoni
Sandro Sorella
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The Sorted Effects Method: Discovering Heterogeneous Effects Beyond Their Averages
2015
Victor Chernozhukov
Iván Fernández‐Val
Ye Luo
+
PDF
Chat
Static and Dynamical Correlation in Diradical Molecules by Quantum Monte Carlo Using the Jastrow Antisymmetrized Geminal Power Ansatz
2014
Andrea Zen
Emanuele Coccia
Ye Luo
Sandro Sorella
Leonardo Guidoni
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Molecular Properties by Quantum Monte Carlo: An Investigation on the Role of the Wave Function Ansatz and the Basis Set in the Water Molecule
2013
Andrea Zen
Ye Luo
Sandro Sorella
Leonardo Guidoni
Common Coauthors
Coauthor
Papers Together
Victor Chernozhukov
12
Iván Fernández‐Val
11
Anouar Benali
11
Paul R. C. Kent
9
Martin Spindler
8
Luke Shulenburger
8
Jaron T. Krogel
6
Shuowen Chen
6
M. Chandler Bennett
5
Jin Li
4
Sandro Sorella
4
Kenneth D. Jordan
4
Olle Heinonen
4
Hyeondeok Shin
4
Andrea Zen
4
Anthony Scemama
3
Faming Liang
3
Jeongnim Kim
3
Thomas Applencourt
3
Pierre‐François Loos
3
Kevin Gasperich
3
Amrita Mathuriya
3
Michel Caffarel
3
Leonardo Guidoni
3
Xiaowei Zhang
2
Miguel A. Morales
2
Edgar Josué Landinez Borda
2
Eric Neuscamman
2
Scott Kostyshak
2
Guglielmo Mazzola
2
Andrea Jokisaari
2
Ilkka Kylänpää
2
Zigan Wang
2
Michele Casula
2
Peter Doak
2
Hongxia Hao
2
Cody Melton
2
Shuai Zhang
2
Luning Zhao
2
Jingnan Xue
2
Bochao Jia
2
Lubos Mitáš
2
Laura E. Ratcliff
2
Raymond C. Clay
2
Brenda M. Rubenstein
2
Alejandro López‐Bezanilla
2
Qizhai Li
2
Fionn D. Malone
2
Emanuele Coccia
2
Jannis Kueck
2
Commonly Cited References
Action
Title
Year
Authors
# of times referenced
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Alleviation of the Fermion-Sign Problem by Optimization of Many-Body Wave Functions
2007
C. J. Umrigar
Julien Toulouse
Claudia Filippi
Sandro Sorella
Richard G. Hennig
8
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PDF
Chat
<tt>QMCPACK</tt>: an open source<i>ab initio</i>quantum Monte Carlo package for the electronic structure of atoms, molecules and solids
2018
Jeongnim Kim
Andrew Baczewski
Todd D. Beaudet
Anouar Benali
M. Chandler Bennett
M. Berrill
Nick S. Blunt
Edgar Josué Landinez Borda
Michele Casula
David M. Ceperley
7
+
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
7
+
PDF
Chat
Sparse Models and Methods for Optimal Instruments With an Application to Eminent Domain
2012
6
+
PDF
Chat
Size-consistent variational approaches to nonlocal pseudopotentials: Standard and lattice regularized diffusion Monte Carlo methods revisited
2010
Michele Casula
Saverio Moroni
Sandro Sorella
Claudia Filippi
6
+
PDF
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Twist-averaged boundary conditions in continuum quantum Monte Carlo algorithms
2001
Chao‐Ping Lin
Fenghua Zong
David M. Ceperley
6
+
PDF
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Improving point and interval estimators of monotone functions by rearrangement
2009
Victor Chernozhukov
Iván Fernández‐Val
Alfred Galichon
6
+
PDF
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Exchangeably Weighted Bootstraps of the General Empirical Process
1993
Jens Præstgaard
Jon A. Wellner
5
+
PDF
Chat
Full optimization of Jastrow–Slater wave functions with application to the first-row atoms and homonuclear diatomic molecules
2008
Julien Toulouse
C. J. Umrigar
5
+
PDF
Chat
Beyond the locality approximation in the standard diffusion Monte Carlo method
2006
Michele Casula
5
+
Quantile and probability curves without crossing
2007
Iván Fernández‐Val
Victor Chernozhukov
Alfred Galichon
4
+
PDF
Chat
Constrained path Monte Carlo method for fermion ground states
1997
Shiwei Zhang
J. Carlson
J. E. Gubernatis
4
+
PDF
Chat
Computing the energy of a water molecule using multideterminants: A simple, efficient algorithm
2011
Bryan K. Clark
Miguel A. Morales
Jeremy McMinis
Jeongnim Kim
Gustavo E. Scuseria
4
+
PDF
Chat
Quantum Monte Carlo analysis of a charge ordered insulating antiferromagnet: the Ti<sub>4</sub>O<sub>7</sub> Magnéli phase
2016
Anouar Benali
Luke Shulenburger
Jaron T. Krogel
Xiaoliang Zhong
Paul R. C. Kent
Olle Heinonen
4
+
Regression Shrinkage and Selection Via the Lasso
1996
Robert Tibshirani
4
+
PDF
Chat
Diffusion Monte Carlo Method with Lattice Regularization
2005
Michele Casula
Claudia Filippi
Sandro Sorella
4
+
PDF
Chat
Quantum Monte Carlo Method using Phase-Free Random Walks with Slater Determinants
2003
Shiwei Zhang
Henry Krakauer
4
+
PDF
Chat
Nature and Strength of Interlayer Binding in Graphite
2009
Leonardo Spanu
Sandro Sorella
Giulia Galli
4
+
PDF
Chat
Correlated geminal wave function for molecules: An efficient resonating valence bond approach
2004
Michele Casula
Claudio Attaccalite
Sandro Sorella
4
+
PDF
Chat
Inference on counterfactual distributions
2009
Blaise Melly
Iván Fernández‐Val
Victor Chernozhukov
4
+
PDF
Chat
Continuum variational and diffusion quantum Monte Carlo calculations
2009
R. J. Needs
M. D. Towler
N. D. Drummond
Pablo López Ríos
4
+
PDF
Chat
Phase stability of TiO<sub>2</sub>polymorphs from diffusion Quantum Monte Carlo
2016
Ye Luo
Anouar Benali
Luke Shulenburger
Jaron T. Krogel
Olle Heinonen
Paul R. C. Kent
4
+
PDF
Chat
Geminal wave functions with Jastrow correlation: A first application to atoms
2003
Michele Casula
Sandro Sorella
4
+
PDF
Chat
Finite-temperature electronic simulations without the Born-Oppenheimer constraint
2012
Guglielmo Mazzola
Andrea Zen
Sandro Sorella
4
+
Resonating valence bond wave function with molecular orbitals: Application to first-row molecules
2009
Mariapia Marchi
Sam Azadi
Michele Casula
Sandro Sorella
4
+
PDF
Chat
Weak binding between two aromatic rings: Feeling the van der Waals attraction by quantum Monte Carlo methods
2007
Sandro Sorella
Michele Casula
Dario Rocca
4
+
PDF
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Dissecting the Hydrogen Bond: A Quantum Monte Carlo Approach
2008
Fabio Sterpone
Leonardo Spanu
Luca Ferraro
Sandro Sorella
Leonardo Guidoni
4
+
PDF
Chat
Towards the Solution of the Many-Electron Problem in Real Materials: Equation of State of the Hydrogen Chain with State-of-the-Art Many-Body Methods
2017
Mário Motta
David M. Ceperley
Garnet Kin‐Lic Chan
John A. Gomez
Emanuel Gull
Sheng Guo
Carlos A. Jiménez-Hoyos
Lan Nguyen Tran
Jia Li
Fengjie Ma
4
+
PDF
Chat
Optimized Structure and Vibrational Properties by Error Affected Potential Energy Surfaces
2012
Andrea Zen
Delyan Zhelyazov
Leonardo Guidoni
4
+
PDF
Chat
Multideterminant Wave Functions in Quantum Monte Carlo
2012
Miguel A. Morales
Jeremy McMinis
Bryan K. Clark
Jeongnim Kim
Gustavo E. Scuseria
4
+
PDF
Chat
The Sorted Effects Method: Discovering Heterogeneous Effects Beyond Their Averages
2018
Victor Chernozhukov
Iván Fernández‐Val
Ye Luo
3
+
PDF
Chat
Structural stability and defect energetics of ZnO from diffusion quantum Monte Carlo
2015
Juan A. Santana
Jaron T. Krogel
Jeongnim Kim
Paul R. C. Kent
Fernando A. Reboredo
3
+
The Elements of Statistical Learning
2001
Trevor Hastie
J. Friedman
Robert Tibshirani
3
+
PDF
Chat
Boosting the accuracy and speed of quantum Monte Carlo: Size consistency and time step
2016
Andrea Zen
Sandro Sorella
M. J. Gillan
Angelos Michaelides
Dario Alfè
3
+
WHAT DO QUANTILE REGRESSIONS IDENTIFY FOR GENERAL STRUCTURAL FUNCTIONS?
2014
Yuya Sasaki
3
+
The Nature of the Interlayer Interaction in Bulk and Few-Layer Phosphorus
2015
Luke Shulenburger
Andrew Baczewski
Zhen Zhu
Jie Guan
David Tománek
3
+
PDF
Chat
Sure Independence Screening for Ultrahigh Dimensional Feature Space
2008
Jianqing Fan
Jinchi Lv
3
+
PDF
Chat
Pfaffian Pairing Wave Functions in Electronic-Structure Quantum Monte Carlo Simulations
2006
Michal Bajdich
Luboš Mitáš
G. Drobný
Lucas K. Wagner
K. E. Schmidt
3
+
PDF
Chat
Van der Waals Density Functional for General Geometries
2004
M. Dion
Hanna A. Rydberg
Elsebeth Schröder
David C. Langreth
Bengt I. Lundqvist
3
+
PDF
Chat
Minimax Rates of Estimation for High-Dimensional Linear Regression Over $\ell_q$-Balls
2011
Garvesh Raskutti
Martin J. Wainwright
Bin Yu
3
+
PDF
Chat
Heat-Bath Configuration Interaction: An Efficient Selected Configuration Interaction Algorithm Inspired by Heat-Bath Sampling
2016
Adam Holmes
Norm M. Tubman
C. J. Umrigar
3
+
PDF
Chat
Applications of quantum Monte Carlo methods in condensed systems
2011
Jindřich Kolorenč
Luboš Mitáš
3
+
PDF
Chat
Pfaffian pairing and backflow wavefunctions for electronic structure quantum Monte Carlo methods
2008
Michal Bajdich
Luboš Mitáš
Lucas K. Wagner
K. E. Schmidt
3
+
PDF
Chat
The graphical lasso: New insights and alternatives
2012
Rahul Mazumder
Trevor Hastie
3
+
Model selection and estimation in the Gaussian graphical model
2007
Ming Yuan
Yi Lin
3
+
Bias reduction of maximum likelihood estimates
1993
David Firth
3
+
PDF
Chat
Wave function optimization in the variational Monte Carlo method
2005
Sandro Sorella
3
+
PDF
Chat
Inhomogeneous backflow transformations in quantum Monte Carlo calculations
2006
Pablo López Ríos
Ao Ma
N. D. Drummond
M. D. Towler
R. J. Needs
3
+
Variable Selection via Nonconcave Penalized Likelihood and its Oracle Properties
2001
Jianqing Fan
Runze Li
3
+
Sparse inverse covariance estimation with the graphical lasso
2007
Jerome H. Friedman
Trevor Hastie
R. Tibshirani
3