Table 1 Electron affinities (eV) of BO2, CH3, Li2H3, NH2, BH4, CN, OH, NO3 and NO2.

From: Iron-based magnetic superhalogens with pseudohalogens as ligands: An unbiased structure search

Clusters

B3LYP

CCSD

Exp.

6-311+G*

6-311+G(2df)

6-311+G*

BO2

4.353

4.326

4.146

4.46a

CH3

−0.003

0.025

−0.525

0.080b

Li2H3

3.292

3.289

3.241

 

NH2

0.597

0.622

0.038

0.771c

BH4

3.287

3.254

2.998

 

CN

4.072

4.055

3.627

3.82d

OH

1.721

1.712

1.145

1.828e

NO3

4.034

3.979

4.035

3.95f

NO2

2.294

2.219

2.038

2.275g

  1. aRef. 46. bRef. 47. cRef. 48. dRef. 49. eRef. 50. fRef. 51. gRef. 52.
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