Xinguo Ren

发表

Large-scale ab initio simulations based on systematically improvable atomic basis

Xiaohui Liu, Lin Lin, Pengfei Li, 2015, 1503.00097.

Realistic Modeling of Materials with Strongly Correlated Electrons

Vladimir I. Anisimov, Karsten Held, Xinguo Ren, 2006 .

Hybrid functionals for large periodic systems in an all-electron, numeric atom-centered basis framework

Sergey V. Levchenko, Matthias Scheffler, Patrick Rinke, 2015, Comput. Phys. Commun..

Efficient Hybrid Density Functional Calculations for Large Periodic Systems Using Numerical Atomic Orbitals.

Peize Lin, Xinguo Ren, Lixin He, 2020, Journal of chemical theory and computation.

Ab initio molecular simulations with numeric atom-centered orbitals

Matthias Scheffler, Ralf Gehrke, Karsten Reuter, 2009, Comput. Phys. Commun..

Accurate stress calculations based on numerical atomic orbital bases: Implementation and benchmarks

Lixin He, Xinguo Ren, Daye Zheng, 2021, Comput. Phys. Commun..

Exploring the random phase approximation: Application to CO adsorbed on Cu(111)

Matthias Scheffler, Patrick Rinke, Xinguo Ren, 2009 .

Enforcing the linear behavior of the total energy with hybrid functionals: Implications for charge transfer, interaction energies, and the random-phase approximation

Matthias Scheffler, Patrick Rinke, Oliver T. Hofmann, 2016 .

Self-consistent GW: an all-electron implementation with localized basis functions

Angel Rubio, Matthias Scheffler, Patrick Rinke, 2013, 1304.4039.

Assessment of correlation energies based on the random-phase approximation

Georg Kresse, Gustavo E. Scuseria, Matthias Scheffler, 2011, 1111.0173.

Unified description of ground and excited states of finite systems: The self-consistent GW approach

Angel Rubio, Matthias Scheffler, Patrick Rinke, 2012, 1202.3547.

Numeric atom-centered-orbital basis sets with valence-correlation consistency from H to Ar

Matthias Scheffler, Patrick Rinke, Xinguo Ren, 2013 .

Random-phase approximation and its applications in computational chemistry and materials science

Matthias Scheffler, Patrick Rinke, Xinguo Ren, 2012, Journal of Materials Science.

Accurate localized resolution of identity approach for linear-scaling hybrid density functionals and for many-body perturbation theory

Matthias Scheffler, Patrick Rinke, Xinguo Ren, 2015 .

Self-consistent Green's function embedding for advanced electronic structure methods based on a dynamical mean-field concept

Matthias Scheffler, Patrick Rinke, Xinguo Ren, 2015, 1506.03680.

Renormalized Second-order Perturbation Theory for The Electron Correlation Energy: Concept, Implementation, and Benchmarks

Gustavo E. Scuseria, Matthias Scheffler, Patrick Rinke, 2012, 1212.3674.

Accurate Ionization Potentials and Electron Affinities of Acceptor Molecules III: A Benchmark of GW Methods.

Patrick Rinke, J. V. Ortiz, Xinguo Ren, 2016, Journal of chemical theory and computation.

Benchmark of GW methods for azabenzenes

Angel Rubio, James R. Chelikowsky, Matthias Scheffler, 2012 .

On the room-temperature phase diagram of high pressure hydrogen: an ab initio molecular dynamics perspective and a diffusion Monte Carlo study.

Enge Wang, Dario Alfè, Xinguo Ren, 2014, The Journal of chemical physics.

Beyond the random-phase approximation for the electron correlation energy: the importance of single excitations.

Alexandre Tkatchenko, Matthias Scheffler, Patrick Rinke, 2010, Physical review letters.

Density-functional theory for f-electron systems: the α-γ phase transition in cerium.

Angel Rubio, Matthias Scheffler, Patrick Rinke, 2012, Physical review letters.

Bond breaking and bond formation: how electron correlation is captured in many-body perturbation theory and density-functional theory.

Angel Rubio, Matthias Scheffler, Patrick Rinke, 2012, Physical review letters.