|
| 1 | +""" |
| 2 | +Functions useful for doing molecular chemistry: |
| 3 | +* molarity_to_normality |
| 4 | +* moles_to_pressure |
| 5 | +* moles_to_volume |
| 6 | +* pressure_and_volume_to_temperature |
| 7 | +""" |
| 8 | + |
| 9 | + |
| 10 | +def molarity_to_normality(nfactor: int, moles: float, volume: float) -> float: |
| 11 | + """ |
| 12 | + Convert molarity to normality. |
| 13 | + Volume is taken in litres. |
| 14 | +
|
| 15 | + Wikipedia reference: https://en.wikipedia.org/wiki/Equivalent_concentration |
| 16 | + Wikipedia reference: https://en.wikipedia.org/wiki/Molar_concentration |
| 17 | +
|
| 18 | + >>> molarity_to_normality(2, 3.1, 0.31) |
| 19 | + 20 |
| 20 | + >>> molarity_to_normality(4, 11.4, 5.7) |
| 21 | + 8 |
| 22 | + """ |
| 23 | + return round((float(moles / volume) * nfactor)) |
| 24 | + |
| 25 | + |
| 26 | +def moles_to_pressure(volume: float, moles: float, temperature: float) -> float: |
| 27 | + """ |
| 28 | + Convert moles to pressure. |
| 29 | + Ideal gas laws are used. |
| 30 | + Temperature is taken in kelvin. |
| 31 | + Volume is taken in litres. |
| 32 | + Pressure has atm as SI unit. |
| 33 | +
|
| 34 | + Wikipedia reference: https://en.wikipedia.org/wiki/Gas_laws |
| 35 | + Wikipedia reference: https://en.wikipedia.org/wiki/Pressure |
| 36 | + Wikipedia reference: https://en.wikipedia.org/wiki/Temperature |
| 37 | +
|
| 38 | + >>> moles_to_pressure(0.82, 3, 300) |
| 39 | + 90 |
| 40 | + >>> moles_to_pressure(8.2, 5, 200) |
| 41 | + 10 |
| 42 | + """ |
| 43 | + return round(float((moles * 0.0821 * temperature) / (volume))) |
| 44 | + |
| 45 | + |
| 46 | +def moles_to_volume(pressure: float, moles: float, temperature: float) -> float: |
| 47 | + """ |
| 48 | + Convert moles to volume. |
| 49 | + Ideal gas laws are used. |
| 50 | + Temperature is taken in kelvin. |
| 51 | + Volume is taken in litres. |
| 52 | + Pressure has atm as SI unit. |
| 53 | +
|
| 54 | + Wikipedia reference: https://en.wikipedia.org/wiki/Gas_laws |
| 55 | + Wikipedia reference: https://en.wikipedia.org/wiki/Pressure |
| 56 | + Wikipedia reference: https://en.wikipedia.org/wiki/Temperature |
| 57 | +
|
| 58 | + >>> moles_to_volume(0.82, 3, 300) |
| 59 | + 90 |
| 60 | + >>> moles_to_volume(8.2, 5, 200) |
| 61 | + 10 |
| 62 | + """ |
| 63 | + return round(float((moles * 0.0821 * temperature) / (pressure))) |
| 64 | + |
| 65 | + |
| 66 | +def pressure_and_volume_to_temperature( |
| 67 | + pressure: float, moles: float, volume: float |
| 68 | +) -> float: |
| 69 | + """ |
| 70 | + Convert pressure and volume to temperature. |
| 71 | + Ideal gas laws are used. |
| 72 | + Temperature is taken in kelvin. |
| 73 | + Volume is taken in litres. |
| 74 | + Pressure has atm as SI unit. |
| 75 | +
|
| 76 | + Wikipedia reference: https://en.wikipedia.org/wiki/Gas_laws |
| 77 | + Wikipedia reference: https://en.wikipedia.org/wiki/Pressure |
| 78 | + Wikipedia reference: https://en.wikipedia.org/wiki/Temperature |
| 79 | +
|
| 80 | + >>> pressure_and_volume_to_temperature(0.82, 1, 2) |
| 81 | + 20 |
| 82 | + >>> pressure_and_volume_to_temperature(8.2, 5, 3) |
| 83 | + 60 |
| 84 | + """ |
| 85 | + return round(float((pressure * volume) / (0.0821 * moles))) |
| 86 | + |
| 87 | + |
| 88 | +if __name__ == "__main__": |
| 89 | + |
| 90 | + import doctest |
| 91 | + |
| 92 | + doctest.testmod() |
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