# Variational bounds and trial states

> For a normalized trial state in the Hamiltonian domain, the expectation of a Hamiltonian bounded below is at least its ground energy.

Course: [Advanced physics methods and spacetime](https://studybrix.com/en/courses/advanced-physics-methods/index.md)
Level: advanced
Prerequisites: Quantum expectation values and optimization.

## Notes

### Bound

For a normalized trial state in the Hamiltonian domain, the expectation of a Hamiltonian bounded below is at least its ground energy.

### Parameters

Optimize a trial-state family to lower the upper bound. A restricted family need not contain the true ground state.

### Normalization

A non-normalized trial function requires the quotient ⟨ψ∣H∣ψ⟩/⟨ψ∣ψ⟩. Omitting the denominator changes the problem.

### Limits

A bound on energy is not automatically a pointwise guarantee about the approximate wavefunction. Excited states require additional conditions.

## Practice questions

### 1. A valid trial-state ground-energy estimate is normally what type of bound?

A. An upper bound
B. A lower bound always
C. Exact for any trial state
D. Unrelated to energy

Answer: An upper bound

Explanation: The Rayleigh quotient is at least the true ground energy under the stated hypotheses.

### 2. For numerator 12 and trial norm squared 3, calculate the Rayleigh quotient.

Answer: 4

Explanation: Divide 12 by 3.

### 3. What improves the best variational bound when enlarging a nested trial family?

A. The Hamiltonian disappears
B. The minimum cannot increase
C. The minimum must always become exact
D. The minimum must increase

Answer: The minimum cannot increase

Explanation: The old trial states remain available in the enlarged family.

### 4. A trial energy is E(a)=a²−4a+7 for real a. Find its minimum value.

Answer: 3

Explanation: Complete the square: (a−2)²+3.

### 5. Why does multiplying a trial function by a nonzero constant not change its Rayleigh quotient?

Sample answer / marking guidance: Both numerator and denominator scale by the squared magnitude of that constant, so the factor cancels.

Explanation: Credit complex magnitude as well as real scaling.

### 6. State why a very accurate variational energy does not alone prove every observable is equally accurate.

Sample answer / marking guidance: The energy constrains an expectation value, while other observables can be sensitive to different state features. Further error analysis or convergence checks are needed.

Explanation: Credit the distinction between quantities being approximated.

### 7. A normalized trial state has probabilities 0.8 and 0.2 on eigenstates of energies 1 and 6. Find its mean energy.

Answer: 2

Explanation: 0.8×1+0.2×6=2.

### 8. Which condition is essential before claiming the simple variational ground-energy bound?

A. A complex-valued energy by design
B. Ignoring boundary conditions
C. A valid trial state in the operator domain
D. A negative normalization

Answer: A valid trial state in the operator domain

Explanation: The expectation and boundary/domain conditions must be well-defined.

## Further reading

- https://ocw.mit.edu/courses/8-09-classical-mechanics-iii-fall-2014/
- https://openstax.org/details/books/university-physics-volume-3

Original AI-assisted educational draft; not independently teacher-reviewed. References support further study, not copied exercises, affiliation or curriculum accreditation.
