Table 1 Simulated powder X-ray data for Li2TiS3 for a = 5.06 Å (The data were obtained using Cu-Kα radiation.)

From: Rock-salt-type lithium metal sulphides as novel positive-electrode materials

h

k

l

2θ/deg

d/Å

Intensity

1

1

1

30.58

2.92

16

2

0

0

35.45

2.53

100

2

2

0

51.01

1.79

61

3

1

1

60.65

1.53

5

2

2

2

63.65

1.46

19

4

0

0

75.03

1.27

8

3

3

1

83.15

1.16

2

4

2

0

85.81

1.13

23

4

2

2

96.45

1.03

18

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