Table 2 A survey on the number of required qubits for the largest simulation of each system studied in this work.

From: Ab initio quantum simulation of strongly correlated materials with quantum embedding

System

Number of cGTOs

k-mesh

Number of qubits

 

(per unit cell)

 

No embedding

This work

1D-H

2

111 = 11

44

8

2D h-BN

26

72 = 49

2548

12

3D NiO

78

43 = 64

9984

20