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Au_rate
E
Si_rate
age
Time since creation
calculator
ASE-calculator name
charge
Net charge in unit cell
|e|
energy
Total energy
eV
fmax
Maximum force
eV/Ang
formula
Chemical formula
id
Uniqe row ID
magmom
Magnetic moment
au
mass
Sum of atomic masses in unit cell
au
natoms
Number of atoms
pbc
Periodic boundary conditions
smax
Maximum stress on unit cell
eV/Ang
3
unique_id
Random (unique) ID
user
Username
volume
Volume of unit cell
Ang
3
Displaying rows 1251-414 out of 414
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Au_rate
E
Si_rate
Time since creation (age)
ASE-calculator name (calculator)
Net charge in unit cell (charge)
Total energy (energy)
Maximum force (fmax)
Magnetic moment (magmom)
Sum of atomic masses in unit cell (mass)
Number of atoms (natoms)
Periodic boundary conditions (pbc)
Maximum stress on unit cell (smax)
Volume of unit cell (volume)
Rows: 25
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25
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ID
✕
Formula
✕
Username
✕
1251
Au
8
Si
4
yangxb
1252
Au
8
Si
4
yangxb
1253
Au
8
Si
4
yangxb
1254
Au
8
Si
4
yangxb
1255
Au
8
Si
4
yangxb
1256
Au
8
Si
4
yangxb
1257
Au
8
Si
4
yangxb
1258
Au
8
Si
4
yangxb
1259
Au
8
Si
4
yangxb
1260
Au
8
Si
4
yangxb
1261
Au
8
Si
4
yangxb
1262
Au
8
Si
4
yangxb
1263
Au
8
Si
4
yangxb
1264
Au
8
Si
4
yangxb
1265
Au
8
Si
4
yangxb
1266
Au
8
Si
4
yangxb
1267
Au
8
Si
4
yangxb
1268
Au
8
Si
4
yangxb
1269
Au
8
Si
4
yangxb
1270
Au
8
Si
4
yangxb
1271
Au
8
Si
4
yangxb
1272
Au
8
Si
4
yangxb
1273
Au
8
Si
4
yangxb
1274
Au
8
Si
4
yangxb
1275
Au
8
Si
4
yangxb
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