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AlAs

AlAs is Zincblende, Sphalerite structured and crystallizes in the cubic F-43m space group. Al(1) is bonded to four equivalent As(1) atoms to form corner-sharing AlAs4 tetrahedra. All Al(1)–As(1) bond lengths are 2.46 Å. As(1) is bonded to four equivalent Al(1) atoms to form corner-sharing AsAl4 tetrahedra.

Highlights

Qubits
Depth
Baseline
1,5003.999×10^9
Phasecraft
2,37026,557
Applications
LEDs

Material info

Name
AlAs
Materials Project ID
mp-2172
Number of atoms
2
Spacegroup
F-43m

Density Functional Theory

Kohn-Sham electrons
29
Kohn-Sham electrons occupied
9
Pseudo family
ONCVPSP

Circuitry

Circuit depth
26,557
Number of interactions
266,435
Number of modes
2,250
Number of qubits
2,370
Number of two-qubit gates
2,271,137

Encoding

Number of groups
125
Modes per group
18
Translatable
2,691
Non-translatable
2,552
Tiled translatable
162,775
Tiled nontranslatable
103,660
System dimensions
[5, 5, 5]

Wannier Functions

Final spread
1.004×10^0
Final variance
8.081×10^-1
Number of iterations
276
Number of Wannier functions
9
Spread difference
8.907×10^-8

Compilation

Algorithm
VQE
Detail
Splitting onsite/NN from NNN+ terms
Number of interactions
106,351
Number of nontranslatable terms
2,552
Number of translatable terms
2,691
Number of tiled translatable terms
162,775
Number of tiled nontranslatable terms
103,660

Hamiltonian

Baseline circuit depth
3.999×10^9
Baseline number of bands
6
Baseline number of qubits
1,500
Coulumb number of cluster sites
19
Coulomb neighbor order
1
Coulomb symmetry checks
true
Hop number of cluster sites
55
Interaction motif neighbor order
1
Number of Coulomb terms
13,668
Number of hopping terms
1,826
Number of Majorana terms
5,460
Number of Wannier tight binding
9
Tau Coulomb terms consistent
1.049×10^-1
Tau hop matrix consistent
5.132×10^-4
Threshold Coulomb terms
7.997×10^-1
Threshold hop matrix
0.01432
Tolerance
0.5
Use interaction
1
Energy window
Distance method
MaxDist
Hop matrix neighbor order
4

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