Calculating Theoretical Density of Single Crystal Silicon

In summary, the theoretical density of a single crystal of Si can be calculated by dividing the mass of the crystal (which is equal to the number of atoms in the crystal multiplied by the mass of each atom) by the volume of the crystal. The lattice constant, which can be found by looking it up or using theory, is needed to calculate the volume. The given density and theoretical density may be the same if the theory used to predict the lattice constant is accurate.
  • #1
perplexabot
Gold Member
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I posted this in the engineering section but no replies : ( ... Let us see if the physicists can help.

Homework Statement


Given: Density (D) of Si is 2.328 g/cm^3. Si has diamond crystal structure.
Find: Theoretical density of a single crystal of Si.


Homework Equations


Theoretical density = m/V


The Attempt at a Solution


I know mass = (number of atoms) x (mass of atom), in a diamond crystal structure there are: [(1/8) x 8] + [(1/2) x 6] + [(1) x 4] = 8 Si atoms/crystal structure

Now calculating volume is my issue, do I need the lattice constant? If so, how does one calculate it?

Or is it just V = (m x 8)/D = (m x 8)/2.328, where m = 28.1 amu converted to grams?
However, if I do that, I think I'll end up with the given density. What is the difference between the given density and theoretical density? Please help.

Thank you.
 
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  • #2
What is the difference between the given density and theoretical density?
If the theory is very good - nothing. (Usually the "given" density will be some empirically determined value.)

For the lattice constant: what is the Si-Si bond length?
 
  • #3
Simon Bridge said:
If the theory is very good - nothing. (Usually the "given" density will be some empirically determined value.)
Hmm, that makes sense. Thank you for clearing that out.

Simon Bridge said:
For the lattice constant: what is the Si-Si bond length?

Well using google the lattice constant for silicon is 5.43095 Angstroms at 300K. Should this constant be given in the problem? So the volume would be (5.43095 * 10^-8)^3 cm^3 ?
 
  • #4
That is what it means all right.

Just looking up the lattice constant is a valid alternative to applying some theory to predict it ;)
 
  • #5
Haha. Thank you. Finally, someone was able to help me out.
 

FAQ: Calculating Theoretical Density of Single Crystal Silicon

What is theoretical density?

Theoretical density is the calculated density of a substance based on its chemical composition and molecular structure, assuming perfect packing of its atoms or molecules.

How is theoretical density different from experimental density?

Theoretical density is a calculated value, while experimental density is measured in a laboratory. Theoretical density is based on ideal conditions, while experimental density takes into account imperfections and variations in the substance.

Why is theoretical density important in science?

Theoretical density helps scientists understand the properties and behavior of materials. It is used in areas such as material synthesis, phase transitions, and structural analysis.

What factors affect theoretical density?

Theoretical density is affected by the molecular weight, packing efficiency, and crystal structure of a substance. External factors such as temperature and pressure can also impact theoretical density.

Can theoretical density be higher or lower than experimental density?

Yes, theoretical density can be higher or lower than experimental density. This is because theoretical density is a calculated value, while experimental density is a measured value that can be influenced by experimental conditions and imperfections in the substance.

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