Yiheng Qiu

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Gustavo E. ScuseriaWelch Professor of Chemistry, Physics & Astronomy, and Materials Science & NanoEngineeringVerificeret mail på rice.edu
Jun LI (李隽)Professor of Chemistry, Tsinghua UniversityVerificeret mail på tsinghua.edu.cn
Jinmo ZhaoRice Univ, Nankai Univ, Tianjin UnivVerificeret mail på rice.edu
Steven WhiteDistinguished Professor of Physics, University of California, IrvineVerificeret mail på uci.edu
Lai-Sheng WangProfessor of Chemistry, Brown UniversityVerificeret mail på brown.edu
W-H-Eugen SchwarzProfessor emer. of Theoretical Chemistry, University of SiegenVerificeret mail på uni-siegen.de
Han-Shi HuAssociate Professor of Chemistry, Tsinghua UniversityVerificeret mail på mail.tsinghua.edu.cn
Matthias DegrooteBoehringer Ingelheim Quantum LabVerificeret mail på boehringer-ingelheim.com
Jing SuCollege of Chemistry, Sichuan UniversityVerificeret mail på scu.edu.cn
Phuong diem DauLawrence Berkeley National LaboratoryVerificeret mail på lbl.gov
Matthew HermesUniversity of ChicagoVerificeret mail på uchicago.edu
Jacob M Wahlen-StrothmanGraduate Student, Rice UniversityVerificeret mail på rice.edu
Jorge DukelskyInstituto de Estructura de la Materia. CSIC.Verificeret mail på csic.es
Jarrod R. McCleanSenior Staff Research Scientist - GoogleVerificeret mail på google.com
Ryan BabbushHead of Quantum Algorithms - GoogleVerificeret mail på google.com
Bryan A. O'GormanIBM QuantumVerificeret mail på ibm.com
Lin LinUniversity of California, BerkeleyVerificeret mail på math.berkeley.edu
Fabian Maximilian FaulstichRensselaer Polytechnic InstituteVerificeret mail på rpi.edu
Guo P. ChenPostdoc, Rice UniversityVerificeret mail på rice.edu
John Alexander GomezPhD Student in Applied Physics, Rice UniversityVerificeret mail på rice.edu

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Yiheng Qiu

Postdoc, Department of Physics and Astronomy University of California, Irvine

Verificeret mail på uci.edu

Electronic Structure Strong Correlation Quantum Chemistry Condensed Matter Physics DMRG


Titel Sortér efter henvisninger Sortér efter årstal Sortér efter titel	Citeret af Citeret af	År
Projected coupled cluster theory Y Qiu, TM Henderson, J Zhao, GE Scuseria The Journal of Chemical Physics 147 (6), 2017	71	2017
Probing the Electronic Structure and Chemical Bonding in Tricoordinate Uranyl Complexes UO₂X₃^– (X = F, Cl, Br, I): Competition between Coulomb Repulsion … J Su, PD Dau, YH Qiu, HT Liu, CF Xu, DL Huang, LS Wang, J Li Inorganic Chemistry 52 (11), 6617-6626, 2013	62	2013
Particle-number projected Bogoliubov-coupled-cluster theory: Application to the pairing Hamiltonian Y Qiu, TM Henderson, T Duguet, GE Scuseria Physical Review C 99 (4), 044301, 2019	52	2019
On the maximum bond multiplicity of carbon: unusual C≣ U quadruple bonding in molecular CUO HS Hu, YH Qiu, XG Xiong, WHE Schwarz, J Li Chemical Science 3 (9), 2786-2796, 2012	49	2012
Merging symmetry projection methods with coupled cluster theory: Lessons from the Lipkin model Hamiltonian JM Wahlen-Strothman, TM Henderson, MR Hermes, M Degroote, Y Qiu, ... The Journal of chemical physics 146 (5), 2017	39	2017
Projected Hartree-Fock theory as a polynomial of particle-hole excitations and its combination with variational coupled cluster theory Y Qiu, TM Henderson, GE Scuseria The Journal of Chemical Physics 146 (18), 2017	33	2017
Communication: Projected Hartree Fock theory as a polynomial similarity transformation theory of single excitations Y Qiu, TM Henderson, GE Scuseria The Journal of Chemical Physics 145 (11), 2016	33	2016
On the gold–ligand covalency in linear [AuX 2]− complexes XG Xiong, YL Wang, CQ Xu, YH Qiu, LS Wang, J Li Dalton Transactions 44 (12), 5535-5546, 2015	30	2015
Theoretical Studies of Structure and Dynamics of Molten Salts: The LiF–ThF₄ System JB Liu, X Chen, YH Qiu, CF Xu, WHE Schwarz, J Li The Journal of Physical Chemistry B 118 (48), 13954-13962, 2014	29	2014
Discontinuous Galerkin discretization for quantum simulation of chemistry JR McClean, FM Faulstich, Q Zhu, B O’Gorman, Y Qiu, SR White, ... New Journal of Physics 22 (9), 093015, 2020	23	2020
Projected coupled cluster theory: Optimization of cluster amplitudes in the presence of symmetry projection Y Qiu, TM Henderson, J Zhao, GE Scuseria The Journal of Chemical Physics 149 (16), 2018	21	2018
Bypassing the energy functional in density functional theory: direct calculation of electronic energies from conditional probability densities RJ McCarty, D Perchak, R Pederson, R Evans, Y Qiu, SR White, K Burke Physical Review Letters 125 (26), 266401, 2020	12	2020
Quadruple bonding of carbon in terminal carbides YH Qiu, HS Hu, G Chen, J Li Science China Chemistry 57, 426-434, 2014	11	2014
Hybrid gausslet/Gaussian basis sets Y Qiu, SR White The Journal of Chemical Physics 155 (18), 2021	9	2021
Spin polynomial similarity transformation for repulsive Hamiltonians: interpolating between coupled cluster and spin-projected unrestricted Hartree–Fock JA Gomez, M Degroote, J Zhao, Y Qiu, GE Scuseria Physical Chemistry Chemical Physics 19 (33), 22385-22394, 2017	5	2017
Conditional probability density functional theory RJ McCarty, D Perchak, R Pederson, R Evans, Y Qiu, S White, K Burke APS March Meeting Abstracts 2021, X21. 005, 2021		2021

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