What Went Wrong in Calculating the Density of Na Metal?

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Discussion Overview

The discussion revolves around the calculation of the density of sodium (Na) metal, specifically addressing an error in the calculation related to the body-centered cubic (BCC) unit cell structure. Participants explore the implications of atomic positioning within the unit cell and how it affects density calculations.

Discussion Character

  • Technical explanation
  • Conceptual clarification
  • Homework-related

Main Points Raised

  • One participant presents a calculation for the density of Na metal based on the number of Na atoms in a BCC unit cell and the volume of the unit cell.
  • Another participant questions the number of atoms in a BCC unit cell, suggesting there are 9 atoms, which prompts a discussion about how atoms are shared among unit cells.
  • A participant clarifies that each corner atom is shared by 8 unit cells, contributing only 1/8th of each atom to the BCC unit cell, in addition to the one atom located in the center.
  • There is an acknowledgment of the importance of returning to the definition of the unit cell to resolve confusion regarding atomic contributions.

Areas of Agreement / Disagreement

Participants generally agree on the concept of atomic sharing in the BCC structure, but there is no consensus on the initial calculation presented, as the original poster seeks clarification on their error.

Contextual Notes

The discussion highlights potential misunderstandings regarding the number of atoms in a BCC unit cell and the calculation of density, but does not resolve the specific error in the original calculation.

Who May Find This Useful

Students and individuals studying crystallography, solid-state physics, or materials science may find this discussion relevant, particularly those interested in understanding unit cell structures and density calculations.

daviddee305
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1. Calculate the density of Na metal. The length of the body-centered cubic unit cell is 4.24 Å.2. Attempted solution:

[4 Na Atoms/unit cell] * [1 mol Na atoms/(6.022*10^23 atoms)] * [22.99g Na/1 mol Na] = 1.527 * 10-22 g/unit cell

(4.24 Å)3 = 7.6225 * 10-23 cm3/unit cell[1.527 * 10-22 g/unit cell] / [7.6225 * 10-23 cm3/unit cell] = 2.00 g/cm3The correct answer is 1.00 g/cm3... What went wrong in my calculations?
 
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daviddee305 said:
body-centered cubic

[4 Na Atoms/unit cell] …

Hi daviddee305! :smile:

There are 9 atoms in a body-centered cubic cell (1 in the centre, and one at each vertex), but how many cells is each atom in (and why)? :wink:
 
Each corner atom is shared by 8 unit cells, so only (1/8)th of each atom belongs to the body-centered cubic. Plus the one in the middle. Thank you.

That was a great follow-up question, exactly what I needed to see through these confusing diagrams in my text.
 
daviddee305 said:
Each corner atom is shared by 8 unit cells, so only (1/8)th of each atom belongs to the body-centered cubic. Plus the one in the middle. Thank you.

That was a great follow-up question, exactly what I needed to see through these confusing diagrams in my text.

Yup … always go back to the definition. :biggrin:

(And now have a look at http://en.wikipedia.org/wiki/Body-centred_cubic. :wink:)
 

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