Calculations of Solid Properties Using Wien2k Package
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Sulfur structure

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Sulfur structure Empty Sulfur structure

Post by Algerien1970 Wed 20 May - 12:48

Sulfur structure 220px-Sulfur-sample


Sulfur: crystal structures:

First structure

Space group: Fdddz
Space group number: 70
Structure: orthorhombic

Cell parameters:

a: 1043.7 pm
b: 1284.5 pm
c: 2436.9 pm
α: 90.000°
β: 90.000°
γ: 90.000°


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Last edited by Algerien1970 on Wed 20 May - 20:33; edited 1 time in total
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Sulfur structure Empty Re: Sulfur structure

Post by Algerien1970 Wed 20 May - 13:59

Second structure

Space group: P21/c
Space group number: 14
Structure: monoclinic

Cell parameters:
a: 1092.6 pm
b: 1085.5 pm
c: 1079.0 pm
α: 90.000°
β: 95.920°
γ: 90.000°


Sulfur structure Atomic10
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