Physics Asked on June 10, 2021
I’ve seen some claims that idempotency ($rho^2=rho$) is necessary and sufficient to guarantee the existence of some state $psi$ such that $rho=|psiranglelanglepsi|$, as well as claims on the trace such as here. However, I have so far been unable to prove a necessary and sufficient condition for a density matrix to represent a pure state.
It is easy to see that if $rho=|psiranglelanglepsi|$ then $rho$ is idempotent:
$$
rho^2=|psiranglelanglepsi|psiranglelanglepsi|=|psiranglelanglepsi|=rho
$$
by normalization. However, the converse has proven more difficult I have been able to show, by expanding in a basis and noting that the eigenvalues of an idempotent matrix are either 0 or 1, that if $rho$ is idempotent then
$$
rho=sum_j lambda_j |psi_jranglelanglepsi_j|
$$
where each $lambda_j$ is either 0 or 1. How can I complete the proof? Alternatively, is idempotency not a sufficient condition for a pure state?
THEOREM 1 If $rho$ is a density matrix (i.e., a positive, unit-trace, trace-class operator, also in an infinite dimensional Hilbert space), then $rho$ is a pure state iff $rho^2=rho$.
Proof. If $rho$ is pure, then $rho^2=rho$. Let us prove the converse implication. Suppose that $rho^2 = rho$ ($rho^2$ is trace class if $rho$ is because the set of trace class operators is a $^*$ ideal of the $C^*$-algebra of bounded operators) then $$0=rho^2-rho = sum_{j} (lambda_j^2 -lambda_j) |psi_jrangle langle psi_j|tag{1}$$ where, from the definition of density matrix (positive unit-trace trace-class operator) $$lambda_j in [0,1]tag{2}$$ and $$sum_j lambda_j =1tag{3}:.$$ Let us assume that there are at least two $jneq j'$ with $lambda_j,lambda_{j'}>0$. We conclude from (2) that both $lambda_j^2-lambda_j<0$ and $lambda_{j'}^2-lambda_{j'}<0$. Since $langle psi_k|psi_h rangle = delta_{hk}$, (1) leads to $$0 = langle psi_{j'}|0 psi_{j'}rangle = lambda_{j'}^2-lambda_{j'} <0$$ that is impossible. We conclude that the assumption that there are at least two $jneq j'$ with $lambda_j,lambda_{j'}>0$ is untenable so that $rho = |psi_jrangle langle psi_j|$. $Box$
With a similar route one easily proves that
THEOREM 2 If $rho$ is a density matrix (also in an infinite dimensional Hilbert space), then $rho$ is a pure state iff $tr(rho^2)=tr(rho)$ ($=1$).
Proof. If $rho$ is pure the thesis it trivial. Let us pass to the converse implication. Since $sum_j lambda_j =1$ and $lambda_jin [0,1]$, if more than one $lambda_j$ does not vanish, every $lambda_j$ is strictly less than $1$, so that we have in particular $lambda^2_j < lambda_j$ for all $j$, which implies $sum_j lambda_j^2 < sum_j lambda_j$. This meas that if $tr(rho^2) = tr(rho)$, then only one $lambda_j$ does not vanish so that $rho$ is pure. $Box$
Correct answer by Valter Moretti on June 10, 2021
Let $rhoge0$ be a positive semidefinite (finite-dimensional) operator, and consider the following three conditions:
Any two of the above imply the remaining one.
(1 and 2 $Longrightarrow$ 3) Positivity implies that we can eigedecompose $rho$ as $rho=sum_k p_k P_k$ with $tr(P_j P_k)=delta_{jk}$, $P_j$ orthogonal projections, and $p_kge0$. Then $tr(rho)=1$ implies $sum_k p_k=1$, and $tr(rho^2)=1$ implies $sum_k p_k^2=1$. These two conditions are compatible only if $p_k=delta_{k,1}$, that is, if $rho=P_1$ for some trace-1 projection $P_1$.
(1 and 3 $Longrightarrow$ 2) This is obvious.
(2 and 3 $Longrightarrow$ 1) Also obvious.
Answered by glS on June 10, 2021
if $rho^2=rho$, the only eigenvalues of $rho$ can be $0$ or $1$, as a matter of fact if
$$ rho|psirangle=lambda|psirangle$$
then
$$ rho^2|psirangle=lambda^2|psirangle=rho|psirangle=lambda|psirangle$$
hence $lambda^2=lambda$, i.e. $lambdain{0,1}$. Since $mathrm{Tr}(rho)=1$, $rho$ can have at most one eigenvalue $1$, hence $rho=|psiranglelangle psi|$.
Answered by user2723984 on June 10, 2021
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