Observables

6H-SiC-graphene

3C-SiC-graphene

1.0Å

1.3Å

1.5Å

2.1Å

2.3Å

2.5Å

Temperature K

298.06

±

3.62

298.03

±

3.58

298.03

±

3.52

297.99

±

3.90

298.05

±

4.20

298.11

±

4.24

Potential energy eV

−6.2414

±

0.0004

−6.2398

±

0.0005

−6.2204

±

0.0004

−6.2179

±

0.0005

−6.2205

±

0.0005

−6.2194

±

0.0005

Total energy eV

−6.2031

±

0.0002

−6.2014

±

0.0002

−6.1821

±

0.0002

−6.1821

±

0.0003

−6.1822

±

0.0003

−6.1811

±

0.0003

Pressure GPa

−11.397

±

0.110

−11.073

±

0.132

−9.937

±

0.111

−11.388

±

0.223

−11.484

±

0.216

−11.208

±

0.196

RSD Å

8.8278

±

0.6516

8.7578

±

0.6685

10.4239

±

0.9430

7.4831

±

0.5632

7.5236

±

0.5797

8.4160

±

0.7692