Coupling interoperable software for quantum simulations of materials

Francois Gygi , Sijia Dong , Giulia Galli , Marco Govoni
Bulletin of the American Physical Society

2021
Quantum Embedding Theory for Strongly Correlated States in Materials.

Giulia Galli , Giulia Galli , Marco Govoni , He Ma
Journal of Chemical Theory and Computation 17 ( 4) 2116 -2125

1
2021
First-principles studies of strongly correlated states in defect spin qubits in diamond

He Ma , Nan Sheng , Marco Govoni , Giulia Galli
Physical Chemistry Chemical Physics 22 ( 44) 25522 -25527

16
2020
Quantum embedding theories to simulate condensed systems on quantum computers

Christian Vorwerk , Nan Sheng , Marco Govoni , Benchen Huang
Nature Computational Science 2 ( 7) 424 -432

11
2022
Green’s function formulation of quantum defect embedding theory

Nan Sheng , Christian Vorwerk , Marco Govoni , Giulia Galli
Journal of Chemical Theory and Computation 18 ( 6) 3512 -3522

35
2022
Quantum simulations of fermionic hamiltonians with efficient encoding and ansatz schemes

Benchen Huang , Nan Sheng , Marco Govoni , Giulia Galli
Journal of Chemical Theory and Computation 19 ( 5) 1487 -1498

13
2023
Green's function formulation of quantum defect embedding theory

Marco Govoni , Nan Sheng , Christian Vorwerk , Benchen Huang
Bulletin of the American Physical Society 68

2023
An Exact Double Counting Scheme for Quantum Defect Embedding Theory

Nan Sheng , Christian Vorwerk , Marco Govoni , Giulia Galli
APS March Meeting Abstracts 2022 K46. 004 -K46. 004

2022
Extrinsic and Intrinsic Defects in MgO and CaO as potential spin-qubit candidates

Christian Vorwerk , Nan Sheng , Marco Govoni , Giulia Galli
APS March Meeting Abstracts 2022 T72. 002 -T72. 002

2022
First-principles Studies of Strongly Correlated States in Defect Spin Qubits in Diamond

Nan Sheng , He Ma , Marco Govoni , Giulia Galli
APS March Meeting Abstracts 2021 V51. 012 -V51. 012

2021
Low-rank Green's function representations applied to dynamical mean-field theory

Nan Sheng , Alexander Hampel , Sophie Beck , Olivier Parcollet
Physical Review B 107 ( 24) 245123 -245123

5
2023
Multiscale Methods for Quantum Many-Body Systems

Nan Sheng
The University of Chicago

2023