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Quantum computing is a type of
computation Computation is any type of arithmetic or non-arithmetic calculation that follows a well-defined model (e.g., an algorithm). Mechanical or electronic devices (or, historically, people) that perform computations are known as ''computers''. An es ...
whose operations can harness the phenomena of quantum mechanics, such as superposition, interference, and entanglement. Devices that perform quantum computations are known as quantum computers. Though current quantum computers may be too small to outperform usual (classical) computers for practical applications, larger realizations are believed to be capable of solving certain computational problems, such as
integer factorization In number theory, integer factorization is the decomposition of a composite number into a product of smaller integers. If these factors are further restricted to prime numbers, the process is called prime factorization. When the numbers are suf ...
(which underlies
RSA encryption RSA (Rivest–Shamir–Adleman) is a public-key cryptosystem that is widely used for secure data transmission. It is also one of the oldest. The acronym "RSA" comes from the surnames of Ron Rivest, Adi Shamir and Leonard Adleman, who publicly ...
), substantially faster than classical computers. The study of quantum computing is a subfield of quantum information science. There are several models of quantum computation with the most widely used being quantum circuits. Other models include the
quantum Turing machine A quantum Turing machine (QTM) or universal quantum computer is an abstract machine used to model the effects of a quantum computer. It provides a simple model that captures all of the power of quantum computation—that is, any quantum algorith ...
, quantum annealing, and adiabatic quantum computation. Most models are based on the quantum bit, or " qubit", which is somewhat analogous to the bit in classical computation. A qubit can be in a 1 or 0 quantum state, or in a superposition of the 1 and 0 states. When it is measured, however, it is always 0 or 1; the probability of either outcome depends on the qubit's quantum state immediately prior to measurement. One model that does not use qubits is continuous variable quantum computation. Efforts towards building a physical quantum computer focus on technologies such as transmons,
ion traps An ion trap is a combination of electric and/or magnetic fields used to capture charged particles — known as ions — often in a system isolated from an external environment. Atomic and molecular ion traps have a number of applications in phy ...
and topological quantum computers, which aim to create high-quality qubits. These qubits may be designed differently, depending on the full quantum computer's computing model, as to whether
quantum logic gate In quantum computing and specifically the quantum circuit model of computation, a quantum logic gate (or simply quantum gate) is a basic quantum circuit operating on a small number of qubits. They are the building blocks of quantum circuits, lik ...
s, quantum annealing, or adiabatic quantum computation are employed. There are currently a number of significant obstacles to constructing useful quantum computers. It is particularly difficult to maintain qubits' quantum states, as they suffer from
quantum decoherence Quantum decoherence is the loss of quantum coherence. In quantum mechanics, particles such as electrons are described by a wave function, a mathematical representation of the quantum state of a system; a probabilistic interpretation of the wave ...
. Quantum computers therefore require
error correction In information theory and coding theory with applications in computer science and telecommunication, error detection and correction (EDAC) or error control are techniques that enable reliable delivery of digital data over unreliable communica ...
. Any computational problem that can be solved by a classical computer can also be solved by a quantum computer. Conversely, any problem that can be solved by a quantum computer can also be solved by a classical computer, at least in principle given enough time. In other words, quantum computers obey the
Church–Turing thesis In computability theory, the Church–Turing thesis (also known as computability thesis, the Turing–Church thesis, the Church–Turing conjecture, Church's thesis, Church's conjecture, and Turing's thesis) is a thesis about the nature of comp ...
. This means that while quantum computers provide no additional advantages over classical computers in terms of computability,
quantum algorithm In quantum computing, a quantum algorithm is an algorithm which runs on a realistic model of quantum computation, the most commonly used model being the quantum circuit model of computation. A classical (or non-quantum) algorithm is a finite sequ ...
s for certain problems have significantly lower
time complexities In computer science, the time complexity is the computational complexity that describes the amount of computer time it takes to run an algorithm. Time complexity is commonly estimated by counting the number of elementary operations performed by t ...
than corresponding known classical algorithms. Notably, quantum computers are believed to be able to quickly solve certain problems that no classical computer could solve in any ''feasible'' amount of time—a feat known as "
quantum supremacy In quantum computing, quantum supremacy or quantum advantage is the goal of demonstrating that a programmable quantum device can solve a problem that no classical computer can solve in any feasible amount of time (irrespective of the usefulness of ...
." The study of the
computational complexity In computer science, the computational complexity or simply complexity of an algorithm is the amount of resources required to run it. Particular focus is given to computation time (generally measured by the number of needed elementary operations) ...
of problems with respect to quantum computers is known as
quantum complexity theory Quantum complexity theory is the subfield of computational complexity theory that deals with complexity classes defined using quantum computers, a computational model based on quantum mechanics. It studies the hardness of computational problems i ...
.


History

For decades, the fields of quantum mechanics and computer science formed distinct academic communities.. Much of modern quantum theory developed in the 1920s to explain the waveparticle duality observed at atomic scales. Digital computers emerged in the 1940s to replace
human computers The term "computer", in use from the early 17th century (the first known written reference dates from 1613), meant "one who computes": a person performing mathematical calculations, before electronic computers became commercially available. Ala ...
for tedious calculations. Both disciplines saw practical applications in the Second World War; computers played a major role in
World War II cryptography Cryptography was used extensively during World War II because of the importance of radio communication and the ease of radio interception. The nations involved fielded a plethora of code and cipher systems, many of the latter using rotor machines. ...
, and the nuclear physics necessary for the Manhattan Project was grounded in quantum physics. Quantum computing began in 1980 when physicist Paul Benioff proposed a quantum mechanical model of the Turing machine. Richard Feynman and Yuri Manin later suggested that a quantum computer had the potential to simulate things a classical computer could not feasibly do. In 1986 Feynman introduced an early version of the quantum circuit notation. In 1994, Peter Shor developed a quantum algorithm for finding the
prime factor A prime number (or a prime) is a natural number greater than 1 that is not a product of two smaller natural numbers. A natural number greater than 1 that is not prime is called a composite number. For example, 5 is prime because the only ways ...
s of an integer with the potential to decrypt
RSA RSA may refer to: Organizations Academia and education * Rabbinical Seminary of America, a yeshiva in New York City *Regional Science Association International (formerly the Regional Science Association), a US-based learned society *Renaissance S ...
-encrypted communications. In 1998 Isaac Chuang, Neil Gershenfeld and Mark Kubinec created the first two- qubit quantum computer that could perform computations. Despite ongoing experimental progress since the late 1990s, most researchers believe that " fault-tolerant quantum computing sstill a rather distant dream." In 2015,
Duke University Duke University is a private research university in Durham, North Carolina. Founded by Methodists and Quakers in the present-day city of Trinity in 1838, the school moved to Durham in 1892. In 1924, tobacco and electric power industrialist James ...
studies estimated that nearly 3 million qubits large fault-tolerant quantum computer could factor 2,048-bit integer in five months. In recent years, investment in quantum computing research has increased in the public and private sectors. On 23 October 2019, Google AI, in partnership with the U.S. National Aeronautics and Space Administration ( NASA), claimed to have performed a quantum computation that was infeasible on any classical computer, but whether this claim was or is still valid is a topic of active research. In December 2021
McKinsey & Company McKinsey & Company is a global management consulting firm founded in 1926 by University of Chicago professor James O. McKinsey, that offers professional services to corporations, governments, and other organizations. McKinsey is the oldest and ...
analysis states that "..investment dollars are pouring in, and quantum-computing start-ups are proliferating". They go on to note that "While quantum computing promises to help businesses solve problems that are beyond the reach and speed of conventional high-performance computers, use cases are largely experimental and hypothetical at this early stage."


Quantum information processing

Computer engineers typically describe a modern computer's operation in terms of classical electrodynamics. Within these "classical" computers, some components (such as
semiconductors A semiconductor is a material which has an electrical resistivity and conductivity, electrical conductivity value falling between that of a electrical conductor, conductor, such as copper, and an insulator (electricity), insulator, such as glas ...
and random number generators) may rely on quantum behavior, but these components are not
isolated Isolation is the near or complete lack of social contact by an individual. Isolation or isolated may also refer to: Sociology and psychology *Isolation (health care), various measures taken to prevent contagious diseases from being spread **Is ...
from their environment, so any quantum information quickly decoheres. While programmers may depend on probability theory when designing a
randomized algorithm A randomized algorithm is an algorithm that employs a degree of randomness as part of its logic or procedure. The algorithm typically uses uniformly random bits as an auxiliary input to guide its behavior, in the hope of achieving good performan ...
, quantum mechanical notions like superposition and interference are largely irrelevant for program analysis.
Quantum program Quantum programming is the process of assembling sequences of instructions, called quantum circuits, that are capable of running on a quantum computer. Quantum programming languages help express quantum algorithms using high-level constructs. The ...
s, in contrast, rely on precise control of coherent quantum systems. Physicists describe these systems mathematically using linear algebra. Complex numbers model probability amplitudes, vectors model quantum states, and matrices model the operations that can be performed on these states. Programming a quantum computer is then a matter of composing operations in such a way that the resulting program computes a useful result in theory and is implementable in practice. The prevailing model of quantum computation describes the computation in terms of a network of quantum logic gates. This model is a complex linear-algebraic generalization of boolean circuits.


Quantum information

A memory consisting of n bits of information has 2^n possible states. A vector representing all memory states thus has 2^n entries (one for each state). This vector is viewed as a '' probability vector'' and represents the fact that the memory is to be found in a particular state. The bits of classical computers are not capable of being in superposition, so one entry must have a value of 1 (i.e. a 100% probability of being in this state) and all other entries would be zero. In quantum mechanics, probability vectors can be generalized to density operators. The quantum state vector formalism is usually introduced first because it is conceptually simpler, and because it can be used instead of the density matrix formalism ''for pure states,'' where the whole quantum system is known. We begin by considering a simple memory consisting of only one
quantum bit In quantum computing, a qubit () or quantum bit is a basic unit of quantum information—the quantum version of the classic binary bit physically realized with a two-state device. A qubit is a two-state (or two-level) quantum-mechanical system ...
. When
measured Measurement is the quantification of attributes of an object or event, which can be used to compare with other objects or events. In other words, measurement is a process of determining how large or small a physical quantity is as compared t ...
, this memory may be found in one of two states: the zero state or the one state. We may represent the state of this memory using Dirac notation so that , 0\rangle := \begin 1 \\ 0 \end;\quad , 1\rangle := \begin 0 \\ 1 \end A quantum memory may then be found in any quantum superposition , \psi\rangle of the two classical states , 0\rangle and , 1\rangle: , \psi\rangle := \alpha\,, 0\rangle + \beta\,, 1\rangle = \begin \alpha \\ \beta \end;\quad , \alpha, ^2 + , \beta, ^2 = 1. The coefficients \alpha and \beta are complex numbers. The state , \psi\rangle is not itself a probability vector but can be connected with a probability vector via the measurement operation. If the quantum memory is measured to determine whether the state is , 0\rangle or , 1\rangle (this is known as a computational basis measurement), the zero state would be observed with probability , \alpha, ^2 and the one state with probability , \beta, ^2. The numbers \alpha and \beta are called probability amplitudes.


Unitary operators

The state of this one-qubit quantum memory can be manipulated by applying
quantum logic gate In quantum computing and specifically the quantum circuit model of computation, a quantum logic gate (or simply quantum gate) is a basic quantum circuit operating on a small number of qubits. They are the building blocks of quantum circuits, lik ...
s, analogous to how classical memory can be manipulated with classical logic gates. One important gate for both classical and quantum computation is the NOT gate, which can be represented by a
matrix Matrix most commonly refers to: * ''The Matrix'' (franchise), an American media franchise ** '' The Matrix'', a 1999 science-fiction action film ** "The Matrix", a fictional setting, a virtual reality environment, within ''The Matrix'' (franchi ...
X := \begin 0 & 1 \\ 1 & 0 \end. Mathematically, the application of such a logic gate to a quantum state vector is modelled with matrix multiplication. Thus X, 0\rangle = , 1\rangle and X, 1\rangle = , 0\rangle. The mathematics of single qubit gates can be extended to operate on multi-qubit quantum memories in two important ways. One way is simply to select a qubit and apply that gate to the target qubit whilst leaving the remainder of the memory unaffected. Another way is to apply the gate to its target only if another part of the memory is in a desired state. These two choices can be illustrated using another example. The possible states of a two-qubit quantum memory are , 00\rangle := \begin 1 \\ 0 \\ 0 \\ 0 \end;\quad , 01\rangle := \begin 0 \\ 1 \\ 0 \\ 0 \end;\quad , 10\rangle := \begin 0 \\ 0 \\ 1 \\ 0 \end;\quad , 11\rangle := \begin 0 \\ 0 \\ 0 \\ 1 \end. The CNOT gate can then be represented using the following matrix: \operatorname := \begin 1 & 0 & 0 & 0 \\ 0 & 1 & 0 & 0 \\ 0 & 0 & 0 & 1 \\ 0 & 0 & 1 & 0 \end. As a mathematical consequence of this definition, \operatorname, 00\rangle = , 00\rangle, \operatorname, 01\rangle = , 01\rangle, \operatorname, 10\rangle = , 11\rangle, and \operatorname, 11\rangle = , 10\rangle. In other words, the CNOT applies a NOT gate (X from before) to the second qubit if and only if the first qubit is in the state , 1\rangle. If the first qubit is , 0\rangle, nothing is done to either qubit. In summary, a quantum computation can be described as a network of quantum logic gates and measurements. However, any measurement can be deferred to the end of quantum computation, though this deferment may come at a computational cost, so most quantum circuits depict a network consisting only of quantum logic gates and no measurements.


Quantum programming

There are a number of models of computation for quantum computing, distinguished by the basic elements in which the computation is decomposed.


Gate array

A quantum gate array decomposes computation into a sequence of few-qubit quantum gates. A quantum computation can be described as a network of quantum logic gates and measurements. However, any measurement can be deferred to the end of quantum computation, though this deferment may come at a computational cost, so most quantum circuits depict a network consisting only of quantum logic gates and no measurements. Any quantum computation (which is, in the above formalism, any unitary matrix of size 2^n \times 2^n over n qubits) can be represented as a network of quantum logic gates from a fairly small family of gates. A choice of gate family that enables this construction is known as a universal gate set, since a computer that can run such circuits is a universal quantum computer. One common such set includes all single-qubit gates as well as the CNOT gate from above. This means any quantum computation can be performed by executing a sequence of single-qubit gates together with CNOT gates. Though this gate set is infinite, it can be replaced with a finite gate set by appealing to the Solovay-Kitaev theorem.


Measurement-based quantum computing

A
measurement-based quantum computer The one-way or measurement-based quantum computer (MBQC) is a method of quantum computing that first prepares an Quantum entanglement, entangled ''resource state'', usually a cluster state or graph state, then performs single qubit measurements o ...
decomposes computation into a sequence of Bell state measurements and single-qubit quantum gates applied to a highly entangled initial state (a cluster state), using a technique called quantum gate teleportation.


Adiabatic quantum computing

An adiabatic quantum computer, based on quantum annealing, decomposes computation into a slow continuous transformation of an initial Hamiltonian into a final Hamiltonian, whose ground states contain the solution.


Topological quantum computing

A topological quantum computer decomposes computation into the braiding of
anyon In physics, an anyon is a type of quasiparticle that occurs only in two-dimensional systems, with properties much less restricted than the two kinds of standard elementary particles, fermions and bosons. In general, the operation of exchangi ...
s in a 2D lattice.


Quantum Turing machine

The
quantum Turing machine A quantum Turing machine (QTM) or universal quantum computer is an abstract machine used to model the effects of a quantum computer. It provides a simple model that captures all of the power of quantum computation—that is, any quantum algorith ...
is theoretically important but the physical implementation of this model is not feasible. All of these models of computation—quantum circuits, one-way quantum computation, adiabatic quantum computation, and topological quantum computation—have been shown to be equivalent to the quantum Turing machine; given a perfect implementation of one such quantum computer, it can simulate all the others with no more than polynomial overhead. This equivalence need not hold for practical quantum computers, since the overhead of simulation may be too large to be practical.


Communication

Quantum cryptography could potentially fulfill some of the functions of public key cryptography. Quantum-based cryptographic systems could, therefore, be more secure than traditional systems against quantum hacking.


Algorithms

Progress in finding quantum algorithms typically focuses on this quantum circuit model, though exceptions like the quantum adiabatic algorithm exist. Quantum algorithms can be roughly categorized by the type of speedup achieved over corresponding classical algorithms.Quantum Algorithm Zoo
– Stephen Jordan's Homepage
Quantum algorithms that offer more than a polynomial speedup over the best-known classical algorithm include Shor's algorithm for factoring and the related quantum algorithms for computing
discrete logarithm In mathematics, for given real numbers ''a'' and ''b'', the logarithm log''b'' ''a'' is a number ''x'' such that . Analogously, in any group ''G'', powers ''b'k'' can be defined for all integers ''k'', and the discrete logarithm log''b' ...
s, solving Pell's equation, and more generally solving the hidden subgroup problem for abelian finite groups. These algorithms depend on the primitive of the quantum Fourier transform. No mathematical proof has been found that shows that an equally fast classical algorithm cannot be discovered, although this is considered unlikely. Certain oracle problems like Simon's problem and the Bernstein–Vazirani problem do give provable speedups, though this is in the quantum query model, which is a restricted model where lower bounds are much easier to prove and doesn't necessarily translate to speedups for practical problems. Other problems, including the simulation of quantum physical processes from chemistry and solid-state physics, the approximation of certain Jones polynomials, and the quantum algorithm for linear systems of equations have quantum algorithms appearing to give super-polynomial speedups and are
BQP In computational complexity theory, bounded-error quantum polynomial time (BQP) is the class of decision problems solvable by a quantum computer in polynomial time, with an error probability of at most 1/3 for all instances.Michael Nielsen and Isa ...
-complete. Because these problems are BQP-complete, an equally fast classical algorithm for them would imply that ''no quantum algorithm'' gives a super-polynomial speedup, which is believed to be unlikely. Some quantum algorithms, like Grover's algorithm and amplitude amplification, give polynomial speedups over corresponding classical algorithms. Though these algorithms give comparably modest quadratic speedup, they are widely applicable and thus give speedups for a wide range of problems. Many examples of provable quantum speedups for query problems are related to Grover's algorithm, including Brassard, Høyer, and Tapp's algorithm for finding collisions in two-to-one functions, which uses Grover's algorithm, and Farhi, Goldstone, and Gutmann's algorithm for evaluating NAND trees, which is a variant of the search problem.


Post-quantum cryptography

A notable application of quantum computation is for attacks on cryptographic systems that are currently in use.
Integer factorization In number theory, integer factorization is the decomposition of a composite number into a product of smaller integers. If these factors are further restricted to prime numbers, the process is called prime factorization. When the numbers are suf ...
, which underpins the security of public key cryptographic systems, is believed to be computationally infeasible with an ordinary computer for large integers if they are the product of few prime numbers (e.g., products of two 300-digit primes). By comparison, a quantum computer could efficiently solve this problem using Shor's algorithm to find its factors. This ability would allow a quantum computer to break many of the
cryptographic Cryptography, or cryptology (from grc, , translit=kryptós "hidden, secret"; and ''graphein'', "to write", or '' -logia'', "study", respectively), is the practice and study of techniques for secure communication in the presence of adve ...
systems in use today, in the sense that there would be a
polynomial time In computer science, the time complexity is the computational complexity that describes the amount of computer time it takes to run an algorithm. Time complexity is commonly estimated by counting the number of elementary operations performed by ...
(in the number of digits of the integer) algorithm for solving the problem. In particular, most of the popular public key ciphers are based on the difficulty of factoring integers or the
discrete logarithm In mathematics, for given real numbers ''a'' and ''b'', the logarithm log''b'' ''a'' is a number ''x'' such that . Analogously, in any group ''G'', powers ''b'k'' can be defined for all integers ''k'', and the discrete logarithm log''b' ...
problem, both of which can be solved by Shor's algorithm. In particular, the
RSA RSA may refer to: Organizations Academia and education * Rabbinical Seminary of America, a yeshiva in New York City *Regional Science Association International (formerly the Regional Science Association), a US-based learned society *Renaissance S ...
, Diffie–Hellman, and elliptic curve Diffie–Hellman algorithms could be broken. These are used to protect secure Web pages, encrypted email, and many other types of data. Breaking these would have significant ramifications for electronic privacy and security. Identifying cryptographic systems that may be secure against quantum algorithms is an actively researched topic under the field of '' post-quantum cryptography''. Some public-key algorithms are based on problems other than the integer factorization and discrete logarithm problems to which Shor's algorithm applies, like the
McEliece cryptosystem In cryptography, the McEliece cryptosystem is an asymmetric encryption algorithm developed in 1978 by Robert McEliece. It was the first such scheme to use randomization in the encryption process. The algorithm has never gained much acceptance in ...
based on a problem in coding theory. Lattice-based cryptosystems are also not known to be broken by quantum computers, and finding a polynomial time algorithm for solving the dihedral hidden subgroup problem, which would break many lattice based cryptosystems, is a well-studied open problem. It has been proven that applying Grover's algorithm to break a symmetric (secret key) algorithm by brute force requires time equal to roughly 2''n''/2 invocations of the underlying cryptographic algorithm, compared with roughly 2''n'' in the classical case, meaning that symmetric key lengths are effectively halved: AES-256 would have the same security against an attack using Grover's algorithm that AES-128 has against classical brute-force search (see '' Key size'').


Search problems

The most well-known example of a problem that allows for a polynomial quantum speedup is ''unstructured search'', which involves finding a marked item out of a list of n items in a database. This can be solved by Grover's algorithm using O(\sqrt) queries to the database, quadratically fewer than the \Omega(n) queries required for classical algorithms. In this case, the advantage is not only provable but also optimal: it has been shown that Grover's algorithm gives the maximal possible probability of finding the desired element for any number of oracle lookups. Problems that can be efficiently addressed with Grover's algorithm have the following properties: #There is no searchable structure in the collection of possible answers, #The number of possible answers to check is the same as the number of inputs to the algorithm, and #There exists a boolean function that evaluates each input and determines whether it is the correct answer For problems with all these properties, the running time of Grover's algorithm on a quantum computer scales as the square root of the number of inputs (or elements in the database), as opposed to the linear scaling of classical algorithms. A general class of problems to which Grover's algorithm can be applied is Boolean satisfiability problem, where the ''database'' through which the algorithm iterates is that of all possible answers. An example and possible application of this is a
password cracker In cryptanalysis and computer security, password cracking is the process of recovering passwords from data that has been stored in or transmitted by a computer system in scrambled form. A common approach (brute-force attack) is to repeatedly try ...
that attempts to guess a password. Breaking symmetric ciphers with this algorithm is of interest to government agencies.


Simulation of quantum systems

Since chemistry and nanotechnology rely on understanding quantum systems, and such systems are impossible to simulate in an efficient manner classically, many believe
quantum simulation Quantum simulators permit the study of a quantum system in a programmable fashion. In this instance, simulators are special purpose devices designed to provide insight about specific physics problems. Note: This manuscript is a contribution o ...
will be one of the most important applications of quantum computing. Quantum simulation could also be used to simulate the behavior of atoms and particles at unusual conditions such as the reactions inside a collider. Quantum simulations might be used to predict future paths of particles and protons under superposition in the
double-slit experiment In modern physics, the double-slit experiment is a demonstration that light and matter can display characteristics of both classically defined waves and particles; moreover, it displays the fundamentally probabilistic nature of quantum mechanics ...
. About 2% of the annual global energy output is used for nitrogen fixation to produce ammonia for the Haber process in the agricultural fertilizer industry while naturally occurring organisms also produce ammonia. Quantum simulations might be used to understand this process of increasing production.


Quantum annealing

Quantum annealing relies on the adiabatic theorem to undertake calculations. A system is placed in the ground state for a simple Hamiltonian, which slowly evolved to a more complicated Hamiltonian whose ground state represents the solution to the problem in question. The adiabatic theorem states that if the evolution is slow enough the system will stay in its ground state at all times through the process.


Machine learning

Since quantum computers can produce outputs that classical computers cannot produce efficiently, and since quantum computation is fundamentally linear algebraic, some express hope in developing quantum algorithms that can speed up machine learning tasks. For example, the quantum algorithm for linear systems of equations, or "HHL Algorithm", named after its discoverers Harrow, Hassidim, and Lloyd, is believed to provide speedup over classical counterparts. Some research groups have recently explored the use of quantum annealing hardware for training Boltzmann machines and deep neural networks.


Computational biology

In the field of
computational biology Computational biology refers to the use of data analysis, mathematical modeling and computational simulations to understand biological systems and relationships. An intersection of computer science, biology, and big data, the field also has fo ...
, quantum computing has the potential to play a big role in solving many biological problems. Given how computational biology is using generic data modeling and storage, its applications to computational biology are expected to arise as well.


Computer-aided drug design and generative chemistry

Deep generative chemistry models emerge as powerful tools to expedite drug discovery. However, the immense size and complexity of the structural space of all possible drug-like molecules pose significant obstacles, which could be overcome in the future by quantum computers. Quantum computers are naturally good for solving complex quantum many-body problems and thus may be instrumental in applications involving quantum chemistry. Therefore, one can expect that quantum-enhanced generative models including quantum GANs may eventually be developed into ultimate generative chemistry algorithms. Hybrid architectures combining quantum computers with deep classical networks, such as Quantum Variational Autoencoders, can already be trained on commercially available annealers and used to generate novel drug-like molecular structures.


Engineering


Challenges

There are a number of technical challenges in building a large-scale quantum computer. Physicist David DiVincenzo has listed these
requirements In product development and process optimization, a requirement is a singular documented physical or functional need that a particular design, product or process aims to satisfy. It is commonly used in a formal sense in engineering design, includi ...
for a practical quantum computer: * Physically scalable to increase the number of qubits * Qubits that can be initialized to arbitrary values * Quantum gates that are faster than decoherence time * Universal gate set * Qubits that can be read easily Sourcing parts for quantum computers is also very difficult. Superconducting quantum computers, like those constructed by Google and IBM, need
helium-3 Helium-3 (3He see also helion) is a light, stable isotope of helium with two protons and one neutron (the most common isotope, helium-4, having two protons and two neutrons in contrast). Other than protium (ordinary hydrogen), helium-3 is the ...
, a
nuclear Nuclear may refer to: Physics Relating to the nucleus of the atom: *Nuclear engineering *Nuclear physics *Nuclear power *Nuclear reactor *Nuclear weapon *Nuclear medicine *Radiation therapy *Nuclear warfare Mathematics *Nuclear space * Nuclear ...
research byproduct, and special superconducting cables made only by the Japanese company Coax Co. The control of multi-qubit systems requires the generation and coordination of a large number of electrical signals with tight and deterministic timing resolution. This has led to the development of quantum controllers which enable interfacing with the qubits. Scaling these systems to support a growing number of qubits is an additional challenge.


Decoherence

One of the greatest challenges involved with constructing quantum computers is controlling or removing
quantum decoherence Quantum decoherence is the loss of quantum coherence. In quantum mechanics, particles such as electrons are described by a wave function, a mathematical representation of the quantum state of a system; a probabilistic interpretation of the wave ...
. This usually means isolating the system from its environment as interactions with the external world cause the system to decohere. However, other sources of decoherence also exist. Examples include the quantum gates, and the lattice vibrations and background thermonuclear spin of the physical system used to implement the qubits. Decoherence is irreversible, as it is effectively non-unitary, and is usually something that should be highly controlled, if not avoided. Decoherence times for candidate systems in particular, the transverse relaxation time ''T''2 (for NMR and MRI technology, also called the ''dephasing time''), typically range between nanoseconds and seconds at low temperature. Currently, some quantum computers require their qubits to be cooled to 20 millikelvin (usually using a dilution refrigerator) in order to prevent significant decoherence. A 2020 study argues that
ionizing radiation Ionizing radiation (or ionising radiation), including nuclear radiation, consists of subatomic particles or electromagnetic waves that have sufficient energy to ionize atoms or molecules by detaching electrons from them. Some particles can travel ...
such as cosmic rays can nevertheless cause certain systems to decohere within milliseconds. As a result, time-consuming tasks may render some quantum algorithms inoperable, as maintaining the state of qubits for a long enough duration will eventually corrupt the superpositions. These issues are more difficult for optical approaches as the timescales are orders of magnitude shorter and an often-cited approach to overcoming them is optical pulse shaping. Error rates are typically proportional to the ratio of operating time to decoherence time, hence any operation must be completed much more quickly than the decoherence time. As described in the Quantum threshold theorem, if the error rate is small enough, it is thought to be possible to use
quantum error correction Quantum error correction (QEC) is used in quantum computing to protect quantum information from errors due to decoherence and other quantum noise. Quantum error correction is theorised as essential to achieve fault tolerant quantum computing that ...
to suppress errors and decoherence. This allows the total calculation time to be longer than the decoherence time if the error correction scheme can correct errors faster than decoherence introduces them. An often-cited figure for the required error rate in each gate for fault-tolerant computation is 10−3, assuming the noise is depolarizing. Meeting this scalability condition is possible for a wide range of systems. However, the use of error correction brings with it the cost of a greatly increased number of required qubits. The number required to factor integers using Shor's algorithm is still polynomial, and thought to be between ''L'' and ''L''2, where ''L'' is the number of digits in the number to be factored; error correction algorithms would inflate this figure by an additional factor of ''L''. For a 1000-bit number, this implies a need for about 104 bits without error correction. With error correction, the figure would rise to about 107 bits. Computation time is about ''L''2 or about 107 steps and at 1 MHz, about 10 seconds. However, other careful estimates lower the qubit count to 3 million for factorizing 2,048-bit integer in 5 months on the trapped-ion quantum computer. A very different approach to the stability-decoherence problem is to create a topological quantum computer with
anyon In physics, an anyon is a type of quasiparticle that occurs only in two-dimensional systems, with properties much less restricted than the two kinds of standard elementary particles, fermions and bosons. In general, the operation of exchangi ...
s,
quasi-particle In physics, quasiparticles and collective excitations are closely related emergent phenomena arising when a microscopically complicated system such as a solid behaves as if it contained different weakly interacting particles in vacuum. For exa ...
s used as threads and relying on braid theory to form stable logic gates.


Quantum supremacy

''
Quantum supremacy In quantum computing, quantum supremacy or quantum advantage is the goal of demonstrating that a programmable quantum device can solve a problem that no classical computer can solve in any feasible amount of time (irrespective of the usefulness of ...
'' is a term coined by John Preskill referring to the engineering feat of demonstrating that a programmable quantum device can solve a problem beyond the capabilities of state-of-the-art classical computers. The problem need not be useful, so some view the quantum supremacy test only as a potential future benchmark. In October 2019, Google AI Quantum, with the help of NASA, became the first to claim to have achieved quantum supremacy by performing calculations on the Sycamore quantum computer more than 3,000,000 times faster than they could be done on
Summit A summit is a point on a surface that is higher in elevation than all points immediately adjacent to it. The topography, topographic terms acme, apex, peak (mountain peak), and zenith are synonymous. The term (mountain top) is generally used ...
, generally considered the world's fastest computer. This claim has been subsequently challenged: IBM has stated that Summit can perform samples much faster than claimed, and researchers have since developed better algorithms for the sampling problem used to claim quantum supremacy, giving substantial reductions to the gap between Sycamore and classical supercomputers and even beating it. In December 2020, a group at USTC implemented a type of
Boson sampling Boson sampling is a restricted model of non-universal quantum computation introduced by Scott Aaronson and Alex Arkhipov after the original work of Lidror Troyansky and Naftali Tishby, that explored possible usage of boson scattering to evaluate ...
on 76 photons with a photonic quantum computer Jiuzhang to demonstrate quantum supremacy. The authors claim that a classical contemporary supercomputer would require a computational time of 600 million years to generate the number of samples their quantum processor can generate in 20 seconds. On November 16, 2021 at the quantum computing summit IBM presented a 127-qubit microprocessor named
IBM Eagle IBM Eagle is a 127-qubit quantum processor Quantum computing is a type of computation whose operations can harness the phenomena of quantum mechanics, such as superposition, interference, and entanglement. Devices that perform quantum computa ...
.


Skepticism

Some researchers have expressed skepticism that scalable quantum computers could ever be built, typically because of the issue of maintaining coherence at large scales, but also for other reasons.
Bill Unruh William George "Bill" Unruh (; born August 28, 1945) is a Canadian physicist at the University of British Columbia, Vancouver who described the hypothetical Unruh effect in 1976. Early life and education Unruh was born into a Mennonite family in ...
doubted the practicality of quantum computers in a paper published in 1994. Paul Davies argued that a 400-qubit computer would even come into conflict with the cosmological information bound implied by the holographic principle. Skeptics like Gil Kalai doubt that quantum supremacy will ever be achieved. Physicist Mikhail Dyakonov has expressed skepticism of quantum computing as follows: :"So the number of continuous parameters describing the state of such a useful quantum computer at any given moment must be... about 10300... Could we ever learn to control the more than 10300 continuously variable parameters defining the quantum state of such a system? My answer is simple. ''No, never.''"


Candidates for physical realizations

For physically implementing a quantum computer, many different candidates are being pursued, among them (distinguished by the physical system used to realize the qubits): * Superconducting quantum computing (qubit implemented by the state of nonlinear resonant superconducting circuits containing Josephson junctions) * Trapped ion quantum computer (qubit implemented by the internal state of trapped ions) *Neutral atoms in optical lattices (qubit implemented by internal states of neutral atoms trapped in an optical lattice) *
Quantum dot Quantum dots (QDs) are semiconductor particles a few nanometres in size, having light, optical and electronics, electronic properties that differ from those of larger particles as a result of quantum mechanics. They are a central topic in nanote ...
computer, spin-based (e.g. the
Loss-DiVincenzo quantum computer The spin qubit quantum computer is a quantum computer based on controlling the spin of charge carriers (electrons and electron holes) in semiconductor devices. The first spin qubit quantum computer was first proposed by Daniel Loss and David P. DiV ...
) (qubit given by the spin states of trapped electrons) *Quantum dot computer, spatial-based (qubit given by electron position in double quantum dot) * Quantum computing using engineered quantum wells, which could in principle enable the construction of quantum computers that operate at room temperature *Coupled quantum wire (qubit implemented by a pair of quantum wires coupled by a quantum point contact) *
Nuclear magnetic resonance quantum computer Nuclear magnetic resonance quantum computing (NMRQC) is one of the several proposed approaches for constructing a quantum computer, that uses the spin states of nuclei within molecules as qubits. The quantum states are probed through the nuclear ma ...
(NMRQC) implemented with the nuclear magnetic resonance of molecules in solution, where qubits are provided by
nuclear spin In atomic physics, the spin quantum number is a quantum number (designated ) which describes the intrinsic angular momentum (or spin angular momentum, or simply spin) of an electron or other particle. The phrase was originally used to describe th ...
s within the dissolved molecule and probed with radio waves *Solid-state NMR
Kane quantum computer The Kane quantum computer is a proposal for a scalable quantum computer proposed by Bruce Kane in 1998,Kane, B.E. (1998A silicon-based nuclear spin quantum computer , ''Nature'', 393, p133 who was then at the University of New South Wales. Often th ...
s (qubit realized by the nuclear spin state of phosphorus donors in silicon) *Vibrational quantum computer (qubits realized by vibrational superpositions in cold molecules) * Electrons-on-helium quantum computers (qubit is the electron spin) * Cavity quantum electrodynamics (CQED) (qubit provided by the internal state of trapped atoms coupled to high-finesse cavities) * Molecular magnet (qubit given by spin states) * Fullerene-based ESR quantum computer (qubit based on the electronic spin of atoms or molecules encased in fullerenes) * Nonlinear optical quantum computer (qubits realized by processing states of different modes of light through both linear and nonlinear elements) * Linear optical quantum computer (qubits realized by processing states of different modes of light through linear elements e.g. mirrors,
beam splitter A beam splitter or ''beamsplitter'' is an optical device that splits a beam of light into a transmitted and a reflected beam. It is a crucial part of many optical experimental and measurement systems, such as interferometers, also finding wide ...
s and phase shifters) *
Diamond-based quantum computer The nitrogen-vacancy center (N-V center or NV center) is one of numerous point defects in diamond. Its most explored and useful property is its photoluminescence, which allows observers to read out its spin-state. The NV center's electron spin, loc ...
(qubit realized by the electronic or nuclear spin of nitrogen-vacancy centers in diamond) * Bose-Einstein condensate-based quantum computer *Transistor-based quantum computer – string quantum computers with entrainment of positive holes using an electrostatic trap *Rare-earth-metal-ion-doped inorganic crystal based quantum computers (qubit realized by the internal electronic state of dopants in optical fibers) *Metallic-like carbon nanospheres-based quantum computers The large number of candidates demonstrates that quantum computing, despite rapid progress, is still in its infancy.


Theory


Computability

Any computational problem solvable by a classical computer is also solvable by a quantum computer. Intuitively, this is because it is believed that all physical phenomena, including the operation of classical computers, can be described using quantum mechanics, which underlies the operation of quantum computers. Conversely, any problem solvable by a quantum computer is also solvable by a classical computer. It is possible to simulate both quantum and classical computers manually with just some paper and a pen, if given enough time. More formally, any quantum computer can be simulated by a Turing machine. In other words, quantum computers provide no additional power over classical computers in terms of computability. This means that quantum computers cannot solve undecidable problems like the halting problem and the existence of quantum computers does not disprove the
Church–Turing thesis In computability theory, the Church–Turing thesis (also known as computability thesis, the Turing–Church thesis, the Church–Turing conjecture, Church's thesis, Church's conjecture, and Turing's thesis) is a thesis about the nature of comp ...
.


Complexity

While quantum computers cannot solve any problems that classical computers cannot already solve, it is suspected that they can solve certain problems faster than classical computers. For instance, it is known that quantum computers can efficiently factor integers, while this is not believed to be the case for classical computers. The class of problems that can be efficiently solved by a quantum computer with bounded error is called
BQP In computational complexity theory, bounded-error quantum polynomial time (BQP) is the class of decision problems solvable by a quantum computer in polynomial time, with an error probability of at most 1/3 for all instances.Michael Nielsen and Isa ...
, for "bounded error, quantum, polynomial time". More formally, BQP is the class of problems that can be solved by a polynomial-time
quantum Turing machine A quantum Turing machine (QTM) or universal quantum computer is an abstract machine used to model the effects of a quantum computer. It provides a simple model that captures all of the power of quantum computation—that is, any quantum algorith ...
with an error probability of at most 1/3. As a class of probabilistic problems, BQP is the quantum counterpart to BPP ("bounded error, probabilistic, polynomial time"), the class of problems that can be solved by polynomial-time probabilistic Turing machines with bounded error. It is known that \mathsf and is widely suspected that \mathsf, which intuitively would mean that quantum computers are more powerful than classical computers in terms of time complexity. The exact relationship of BQP to P, NP, and PSPACE is not known. However, it is known that \mathsf; that is, all problems that can be efficiently solved by a deterministic classical computer can also be efficiently solved by a quantum computer, and all problems that can be efficiently solved by a quantum computer can also be solved by a deterministic classical computer with polynomial space resources. It is further suspected that BQP is a strict superset of P, meaning there are problems that are efficiently solvable by quantum computers that are not efficiently solvable by deterministic classical computers. For instance,
integer factorization In number theory, integer factorization is the decomposition of a composite number into a product of smaller integers. If these factors are further restricted to prime numbers, the process is called prime factorization. When the numbers are suf ...
and the discrete logarithm problem are known to be in BQP and are suspected to be outside of P. On the relationship of BQP to NP, little is known beyond the fact that some NP problems that are believed not to be in P are also in BQP (integer factorization and the discrete logarithm problem are both in NP, for example). It is suspected that \mathsf; that is, it is believed that there are efficiently checkable problems that are not efficiently solvable by a quantum computer. As a direct consequence of this belief, it is also suspected that BQP is disjoint from the class of NP-complete problems (if an NP-complete problem were in BQP, then it would follow from
NP-hard In computational complexity theory, NP-hardness ( non-deterministic polynomial-time hardness) is the defining property of a class of problems that are informally "at least as hard as the hardest problems in NP". A simple example of an NP-hard pr ...
ness that all problems in NP are in BQP). The relationship of BQP to the basic classical complexity classes can be summarized as follows: :\mathsf It is also known that BQP is contained in the complexity class (or more precisely in the associated class of decision problems ), which is a subclass of PSPACE. It has been speculated that further advances in physics could lead to even faster computers. For instance, it has been shown that a non-local hidden variable quantum computer based on Bohmian Mechanics could implement a search of an -item database in at most O(\sqrt steps, a slight speedup over Grover's algorithm, which runs in O(\sqrt) steps. Note, however, that neither search method would allow quantum computers to solve NP-complete problems in polynomial time. Theories of
quantum gravity Quantum gravity (QG) is a field of theoretical physics that seeks to describe gravity according to the principles of quantum mechanics; it deals with environments in which neither gravitational nor quantum effects can be ignored, such as in the vi ...
, such as M-theory and
loop quantum gravity Loop quantum gravity (LQG) is a theory of quantum gravity, which aims to merge quantum mechanics and general relativity, incorporating matter of the Standard Model into the framework established for the pure quantum gravity case. It is an attem ...
, may allow even faster computers to be built. However, defining computation in these theories is an open problem due to the problem of time; that is, within these physical theories there is currently no obvious way to describe what it means for an observer to submit input to a computer at one point in time and then receive output at a later point in time. See section 7 "Quantum Gravity": " €¦to anyone who wants a test or benchmark for a favorite quantum gravity theory, uthor's footnote: That is, one without all the bother of making numerical predictions and comparing them to observationlet me humbly propose the following: ''can you define Quantum Gravity Polynomial-Time?'' €¦until we can say what it means for a 'user' to specify an 'input' and ‘later' receive an 'output'—''there is no such thing as computation, not even theoretically.''" (emphasis in original)


See also

* Chemical computer * D-Wave Systems * DNA computing * Electronic quantum holography * Glossary of quantum computing *
Intelligence Advanced Research Projects Activity The Intelligence Advanced Research Projects Activity (IARPA) is an organization within the Office of the Director of National Intelligence responsible for leading research to overcome difficult challenges relevant to the United States Intellige ...
*
Kane quantum computer The Kane quantum computer is a proposal for a scalable quantum computer proposed by Bruce Kane in 1998,Kane, B.E. (1998A silicon-based nuclear spin quantum computer , ''Nature'', 393, p133 who was then at the University of New South Wales. Often th ...
*
List of emerging technologies This is a list of emerging technologies, in-development technical innovations with significant potential in their applications. The criteria for this list is that the technology must: # Exist in some way; purely hypothetical technologies can ...
* List of quantum processors * Magic state distillation * Natural computing * Optical computing * Post-quantum cryptography *
Quantum algorithm In quantum computing, a quantum algorithm is an algorithm which runs on a realistic model of quantum computation, the most commonly used model being the quantum circuit model of computation. A classical (or non-quantum) algorithm is a finite sequ ...
* Quantum annealing * Quantum bus * Quantum cognition * Quantum circuit *
Quantum complexity theory Quantum complexity theory is the subfield of computational complexity theory that deals with complexity classes defined using quantum computers, a computational model based on quantum mechanics. It studies the hardness of computational problems i ...
* Quantum cryptography *
Quantum logic gate In quantum computing and specifically the quantum circuit model of computation, a quantum logic gate (or simply quantum gate) is a basic quantum circuit operating on a small number of qubits. They are the building blocks of quantum circuits, lik ...
* Quantum machine learning *
Quantum supremacy In quantum computing, quantum supremacy or quantum advantage is the goal of demonstrating that a programmable quantum device can solve a problem that no classical computer can solve in any feasible amount of time (irrespective of the usefulness of ...
* Quantum threshold theorem *
Quantum volume Quantum volume is a metric that measures the capabilities and error rates of a quantum computer. It expresses the maximum size of square quantum circuits that can be implemented successfully by the computer. The form of the circuits is independent ...
*
Rigetti Computing Rigetti Computing is a Berkeley, California-based developer of quantum integrated circuits used for quantum computers. The company also develops a cloud platform called Forest that enables programmers to write quantum algorithms. History Rigetti ...
*
Supercomputer A supercomputer is a computer with a high level of performance as compared to a general-purpose computer. The performance of a supercomputer is commonly measured in floating-point operations per second ( FLOPS) instead of million instructions ...
* Superposition * Theoretical computer science *
Timeline of quantum computing and communication This is a timeline of quantum computing. 1960s 1968 * Stephen Wiesner invents conjugate coding. (published in ACM SIGACT News 15(1):78–88) 1970s 1970 * James Park articulates the no-cloning theorem. 1973 * Alexander Holevo pu ...
* Topological quantum computer * Valleytronics


Notes


References


Further reading


Textbooks

* * * * * * * * * * * * * * * * * *


Academic papers

* * * * Table 1 lists switching and dephasing times for various systems. * * * *


External links

*
Stanford Encyclopedia of Philosophy The ''Stanford Encyclopedia of Philosophy'' (''SEP'') combines an online encyclopedia of philosophy with peer-reviewed publication of original papers in philosophy, freely accessible to Internet users. It is maintained by Stanford University. Eac ...
:
Quantum Computing
by Amit Hagar and Michael E. Cuffaro. *
Quantum computing for the very curious
by Andy Matuschak and Michael Nielsen ;Lectures
Quantum computing for the determined
– 22 video lectures by Michael Nielsen
Video Lectures
by David Deutsch
Lectures at the Institut Henri Poincaré (slides and videos)

Online lecture on An Introduction to Quantum Computing, Edward Gerjuoy (2008)
* Lomonaco, Sam

{{Authority control Models of computation Quantum cryptography Information theory Computational complexity theory Classes of computers Theoretical computer science Open problems Computer-related introductions in 1980 Emerging technologies