Recent advances have demonstrated that $\mathcal{O}(\log M)$ measurements suffice to predict $M$ properties of arbitrarily large quantum many-body systems. However, these remarkable findings assume that the properties to be predicted are chosen independently of the data. This assumption can be violated in practice, where scientists adaptively select properties after looking at previous predictions. This work investigates the adaptive setting for three classes of observables: local, Pauli, and bounded-Frobenius-norm observables. We prove that $\Omega(\sqrt{M})$ samples of an arbitrarily large unknown quantum state are necessary to predict expectation values of $M$ adaptively chosen local and Pauli observables. We also present computationally-efficient algorithms that achieve this information-theoretic lower bound. In contrast, for bounded-Frobenius-norm observables, we devise an algorithm requiring only $\mathcal{O}(\log M)$ samples, independent of system size. Our results highlight the potential pitfalls of adaptivity in analyzing data from quantum experiments and provide new algorithmic tools to safeguard against erroneous predictions in quantum experiments.

Certifying that an n-qubit state synthesized in the lab is close to the target state is a fundamental task in quantum information science. However, existing rigorous protocols either require deep quantum circuits or exponentially many single-qubit measurements. In this work, we prove that almost all n-qubit target states, including those with exponential circuit complexity, can be certified from only O(n^2) single-qubit measurements. This result is established by a new technique that relates certification to the mixing time of a random walk. Our protocol has applications for benchmarking quantum systems, for optimizing quantum circuits to generate a desired target state, and for learning and verifying neural networks, tensor networks, and various other representations of quantum states using only single-qubit measurements. We show that such verified representations can be used to efficiently predict highly non-local properties that would otherwise require an exponential number of measurements. We demonstrate these applications in numerical experiments with up to 120 qubits, and observe advantage over existing methods such as cross-entropy benchmarking (XEB).

Despite fundamental interests in learning quantum circuits, the existence of a computationally efficient algorithm for learning shallow quantum circuits remains an open question. Because shallow quantum circuits can generate distributions that are classically hard to sample from, existing learning algorithms do not apply. In this work, we present a polynomial-time classical algorithm for learning the description of any unknown $n$-qubit shallow quantum circuit $U$ (with arbitrary unknown architecture) within a small diamond distance using single-qubit measurement data on the output states of $U$. We also provide a polynomial-time classical algorithm for learning the description of any unknown $n$-qubit state $\lvert \psi \rangle = U \lvert 0^n \rangle$ prepared by a shallow quantum circuit $U$ (on a 2D lattice) within a small trace distance using single-qubit measurements on copies of $\lvert \psi \rangle$. Our approach uses a quantum circuit representation based on local inversions and a technique to combine these inversions. This circuit representation yields an optimization landscape that can be efficiently navigated and enables efficient learning of quantum circuits that are classically hard to simulate.

While quantum state tomography is notoriously hard, most states hold little interest to practically-minded tomographers. Given that states and unitaries appearing in Nature are of bounded gate complexity, it is natural to ask if efficient learning becomes possible. In this work, we prove that to learn a state generated by a quantum circuit with $G$ two-qubit gates to a small trace distance, a sample complexity scaling linearly in $G$ is necessary and sufficient. We also prove that the optimal query complexity to learn a unitary generated by $G$ gates to a small average-case error scales linearly in $G$. While sample-efficient learning can be achieved, we show that under reasonable cryptographic conjectures, the computational complexity for learning states and unitaries of gate complexity $G$ must scale exponentially in $G$. We illustrate how these results establish fundamental limitations on the expressivity of quantum machine learning models and provide new perspectives on no-free-lunch theorems in unitary learning. Together, our results answer how the complexity of learning quantum states and unitaries relate to the complexity of creating these states and unitaries.

Entanglement is a useful resource for learning, but a precise characterization of its advantage can be challenging. In this work, we consider learning algorithms without entanglement to be those that only utilize separable states, measurements, and operations between the main system of interest and an ancillary system. These algorithms are equivalent to those that apply quantum circuits on the main system interleaved with mid-circuit measurements and classical feedforward. We prove a tight lower bound for learning Pauli channels without entanglement that closes a cubic gap between the best-known upper and lower bound. In particular, we show that $\Theta(2^n\varepsilon^{-2})$ rounds of measurements are required to estimate each eigenvalue of an $n$-qubit Pauli channel to $\varepsilon$ error with high probability when learning without entanglement. In contrast, a learning algorithm with entanglement only needs $\Theta(\varepsilon^{-2})$ rounds of measurements. The tight lower bound strengthens the foundation for an experimental demonstration of entanglement-enhanced advantages for characterizing Pauli noise.

Generalization bounds are a critical tool to assess the training data requirements of Quantum Machine Learning (QML). Recent work has established guarantees for in-distribution generalization of quantum neural networks (QNNs), where training and testing data are drawn from the same data distribution. However, there are currently no results on out-of-distribution generalization in QML, where we require a trained model to perform well even on data drawn from a different distribution to the training distribution. Here, we prove out-of-distribution generalization for the task of learning an unknown unitary. In particular, we show that one can learn the action of a unitary on entangled states having trained only product states. Since product states can be prepared using only single-qubit gates, this advances the prospects of learning quantum dynamics on near term quantum hardware, and further opens up new methods for both the classical and quantum compilation of quantum circuits.

The success of modern deep learning hinges on the ability to train neural networks at scale. Through clever reuse of intermediate information, backpropagation facilitates training through gradient computation at a total cost roughly proportional to running the function, rather than incurring an additional factor proportional to the number of parameters - which can now be in the trillions. Naively, one expects that quantum measurement collapse entirely rules out the reuse of quantum information as in backpropagation. But recent developments in shadow tomography, which assumes access to multiple copies of a quantum state, have challenged that notion. Here, we investigate whether parameterized quantum models can train as efficiently as classical neural networks. We show that achieving backpropagation scaling is impossible without access to multiple copies of a state. With this added ability, we introduce an algorithm with foundations in shadow tomography that matches backpropagation scaling in quantum resources while reducing classical auxiliary computational costs to open problems in shadow tomography. These results highlight the nuance of reusing quantum information for practical purposes and clarify the unique difficulties in training large quantum models, which could alter the course of quantum machine learning.

We present an efficient machine learning (ML) algorithm for predicting any unknown quantum process $\mathcal{E}$ over $n$ qubits. For a wide range of distributions $\mathcal{D}$ on arbitrary $n$-qubit states, we show that this ML algorithm can learn to predict any local property of the output from the unknown process~$\mathcal{E}$, with a small average error over input states drawn from $\mathcal{D}$. The ML algorithm is computationally efficient even when the unknown process is a quantum circuit with exponentially many gates. Our algorithm combines efficient procedures for learning properties of an unknown state and for learning a low-degree approximation to an unknown observable. The analysis hinges on proving new norm inequalities, including a quantum analogue of the classical Bohnenblust-Hille inequality, which we derive by giving an improved algorithm for optimizing local Hamiltonians. Numerical experiments on predicting quantum dynamics with evolution time up to $10^6$ and system size up to $50$ qubits corroborate our proof. Overall, our results highlight the potential for ML models to predict the output of complex quantum dynamics much faster than the time needed to run the process itself.

Quantum process learning is emerging as an important tool to study quantum systems. While studied extensively in coherent frameworks, where the target and model system can share quantum information, less attention has been paid to whether the dynamics of quantum systems can be learned without the system and target directly interacting. Such incoherent frameworks are practically appealing since they open up methods of transpiling quantum processes between the different physical platforms without the need for technically challenging hybrid entanglement schemes. Here we provide bounds on the sample complexity of learning unitary processes incoherently by analyzing the number of measurements that are required to emulate well-established coherent learning strategies. We prove that if arbitrary measurements are allowed, then any efficiently representable unitary can be efficiently learned within the incoherent framework; however, when restricted to shallow-depth measurements only low-entangling unitaries can be learned. We demonstrate our incoherent learning algorithm for low entangling unitaries by successfully learning a 16-qubit unitary on \texttt{ibmq\_kolkata}, and further demonstrate the scalabilty of our proposed algorithm through extensive numerical experiments.

Quantum computing exploits entanglement, superposition, and interference to perform certain tasks with significant speedups over classical computing, The recognition that the world is quantum mechanical sometimes even exponentially faster. Indeed while such has allowed researchers to embed well-established, but speedup has already been observed for a contrived problem classical, theories into the framework of quantum Hilbert [7], reaching it for data science is still uncertain even spaces. Shannon's information theory, which is the basis at the theoretical level, but this is one of the main goals of communication technology, has been generalized for QML. to quantum Shannon theory (or quantum information theory), opening up the possibility that quantum effects In practice, QML is a broad term that encompasses all could make information transmission more efficient [1]. of the tasks shown in Figure 1. For example, one can apply The field of biology has been extended to quantum biology machine learning to quantum applications like discovering to allow for a deeper understanding of biological quantum algorithms [8] or optimizing quantum experiments processes like photosynthesis, smell, and enzyme catalysis [9, 10], or one can use a quantum neural network [2]. Turing's theory of universal computation has been to process either classical or quantum information [11].