4. Fundamentals of Quantum Mechanics

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Chemistry

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24 Terms

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Evidence for wave-nature of particles

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Define probability distribution 

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Wave particle duality

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Classical vs Quantal Descriptions of Nature

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Define ψ² and explain its interpretation 

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Calculate energy of a particle in a 1D box

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How PIB energy changes based on mass, length, and principle quantum number

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Define phase of a wavefunction

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Define Zero-Point Energy and explain its physical interpretation 

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Wave Diffraction

The bending and spreading of waves around obstacles or through openings

<p><span>The bending and spreading of waves around obstacles or through openings</span></p>
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Wave Interference

When two or more waves interact causing the amplitude of the resulting wave to be greater (constructive interference) or smaller (destructive interference) than the individual waves

<p><span>When two or more waves  interact causing the amplitude of the resulting wave to be greater (constructive interference) or smaller (destructive interference) than the individual waves</span></p>
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De Broglie Equation

λ = h/mv

λ = wavelength (m)

h= Planck’s Constant: 6.626×10⁻³⁴

m= Mass of the particle (kg)

V= Velocity of the particle (m/s)

Use: when you need to determine the wavelength of a moving object

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Transverse Wave Characteristics

  • Amplitude: difference between midpoint and wave crest

  • Wavelength: length of one complete cycle

  • Frequency: Number of complete cycles per unit time

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Speed of Wave Travel

λ = v/f

λ = The wavelength (m)

v= velocity (m/s)

f = frequency (s^-1, Hz)

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Nodes

When the oscillation amplitude of a standing wave equals zero. They are areas where the phases change.

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Calculating energy of a classic particle in a box

E = (1/2) mv²

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The Schrödinger Equation

-(h²/8π²m) (d²Ψ(x)/dx²) + V(x)Ψ(x) = EΨ(x)

Where:

  • h= Planck’s Constant: 6.626×10⁻³⁴

  • m = the particle mass

  • x = the particle position

  • V = the potential energY

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The Schrödinger Equation For Quantum Particle in a Box

-(h²/8π²m) (d²/dx²)Ψ = EΨ

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Complete Wave-function for a Particle in a One-Dimensional Box

Ψn(x) = √(2/L) sin (nπx/L)

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Calculating for the Energy of a Particle

En = (h²n²)/8mL²

As the value of n increases, the energy increases. N is restricted to positive integers so there can only be specific values, meaning it’s quantized.

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The Ground State

n=1 where there is the lowest possible energy. The lowest energy of a confined quantum particle must always be > than zero. These particles are never at rest.

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Zero-Point Energy

The difference between the ground state energy (n=1) and zero.

En = (h²)/8mL²

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Excited States

When energy is higher than the ground state. There are infinitely many.

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Change of energy between energy levels

ΔE = Ef - Ei = (h²)/8mL² (n²f - n²i)