Table 1 Calculated and experimental lattice parameters for metals.

From: High-throughput dataset of impurity adsorption on common catalysts in biomass upgrading applications

Metal

Calculated

Experimental

a (Å)

c (Å)

a (Å)

c (Å)

Ag

4.074

—

4.07829

—

Au

4.099

—

4.078630

—

Co

2.470

3.983

2.50331

4.057431

Cu

3.567

—

3.6132

—

Fe

2.801

—

2.86633

—

Ir

3.837

—

3.839234

—

Ni

3.479

—

3.52435

—

Pd

3.885

—

3.890936

—

Pt

3.920

—

3.92437

—

Re

2.752

4.463

2.76238

4.45538

Rh

3.786

—

3.839

—

Ru

2.692

4.248

2.706240

4.281540

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