An important and usual sort of search problems is to find all marked states from an unsorted database with a large number of states. Grover's original quantum search algorithm is for finding single marked state with ...An important and usual sort of search problems is to find all marked states from an unsorted database with a large number of states. Grover's original quantum search algorithm is for finding single marked state with uncertainty, and it has been generalized to the case of multiple marked states, as well as been modified to find single marked state with certainty. However, the query complexity for finding all multiple marked states has not been addressed. We use a generalized Long's algorithm with high precision to solve such a problem. We calculate the approximate query complexity, which increases with the number of marked states and with the precision that we demand. In the end we introduce an algorithm for the problem on a "duality computer" and show its advantage over other algorithms.展开更多
The title complex is widely used as an efficient key component of Ziegler-Natta catalyst for stereospecific polymerization of dienes to produce synthetic rubbers. However, the quantitative structure-activity relations...The title complex is widely used as an efficient key component of Ziegler-Natta catalyst for stereospecific polymerization of dienes to produce synthetic rubbers. However, the quantitative structure-activity relationship(QSAR) of this kind of complexes is still not clear mainly due to the difficulties to obtain their geometric molecular structures through laboratory experiments. An alternative solution is the quantum chemistry calculation in which the comformational population shall be determined. In this study, ten conformers of the title complex were obtained with the function of molecular dynamics conformational search in Gabedit 2.4.8, and their geometry optimization and thermodynamics calculation were made with a Sparkle/PM7 approach in MOPAC 2012. Their Gibbs free energies at 1 atm. and 298.15 K were calculated. Population of the conformers was further calculated out according to the theory of Boltzmann distribution, indicating that one of the ten conformers has a dominant population of 77.13%.展开更多
This work proposes quantum circuit complexity—the minimal number of elementary operations needed to implement a quantum transformation—be established as a legitimate physical observable. We prove that circuit comple...This work proposes quantum circuit complexity—the minimal number of elementary operations needed to implement a quantum transformation—be established as a legitimate physical observable. We prove that circuit complexity satisfies all requirements for physical observables, including self-adjointness, gauge invariance, and a consistent measurement theory with well-defined uncertainty relations. We develop complete protocols for measuring complexity in quantum systems and demonstrate its connections to gauge theory and quantum gravity. Our results suggest that computational requirements may constitute physical laws as fundamental as energy conservation. This framework grants insights into the relationship between quantum information, gravity, and the emergence of spacetime geometry while offering practical methods for experimental verification. Our results indicate that the physical universe may be governed by both energetic and computational constraints, with profound implications for our understanding of fundamental physics.展开更多
Quantum information processing and communication(QIPC) is an area of science that has two main goals: On one side,it tries to explore(still not well known) potential of quantum phenomena for(efficient and reliable) in...Quantum information processing and communication(QIPC) is an area of science that has two main goals: On one side,it tries to explore(still not well known) potential of quantum phenomena for(efficient and reliable) information processing and(efficient,reliable and secure) communication.On the other side,it tries to use quantum information storing,processing and transmitting paradigms,principles,laws,limitations,concepts,models and tools to get deeper insights into the phenomena of quantum world and to find efficient ways to describe and handle/simulate various complex physical phenomena.In order to do that QIPC has to use concepts,models,theories,methods and tools of both physics and informatics.The main role of physics at that is to discover primitive physical phenomena that can be used to design and maintain complex and reliable information storing,processing and transmitting systems.The main role of informatics is,one one side,to explore,from the information processing and communication point of view,limitations and potentials of the potential quantum information processing and communication technology,and to prepare information processing methods that could utilise potential of quantum information processing and communication technologies.On the other side,the main role of informatics is to guide and support,by theoretical tools and outcomes,physics oriented research in QIPC.The paper is to describe and analyse a variety of ways and potential informatics contributes and should/could contribute to the development of QIPC--see also Gruska(1999,2006,2008).展开更多
Matroid theory has been developed to be a mature branch of mathematics and has extensive applications in combinatorial optimization,algorithm design and so on.On the other hand,quantum computing has attracted much att...Matroid theory has been developed to be a mature branch of mathematics and has extensive applications in combinatorial optimization,algorithm design and so on.On the other hand,quantum computing has attracted much attention and has been shown to surpass classical computing on solving some computational problems.Surprisingly,crossover studies of the two fields seem to be missing in the literature.This paper initiates the study of quantum algorithms for matroid property problems.It is shown that quadratic quantum speedup is possible for the calculation problem of finding the girth or the number of circuits(bases,flats,hyperplanes)of a matroid,and for the decision problem of deciding whether a matroid is uniform or Eulerian,by giving a uniform lower boundΩ■on the query complexity of all these problems.On the other hand,for the uniform matroid decision problem,an asymptotically optimal quantum algorithm is proposed which achieves the lower bound,and for the girth problem,an almost optimal quantum algorithm is given with query complexityO■.In addition,for the paving matroid decision problem,a lower boundΩ■on the query complexity is obtained,and an O■ quantum algorithm is presented.展开更多
The aim of this paper is to establish a mathematical fundamental of complex duality quantum computers(CDQCs) acting on vector-states(pure states) and operator-states(mixed states),respectively.A CDQC consists of a com...The aim of this paper is to establish a mathematical fundamental of complex duality quantum computers(CDQCs) acting on vector-states(pure states) and operator-states(mixed states),respectively.A CDQC consists of a complex divider,a group of quantum gates represented by unitary operators,or quantum operations represented by completely positive and trace-preserving mappings,and a complex combiner.It is proved that the divider and the combiner of a CDQC are an isometry and a contraction,respectively.It is proved that the divider and the combiner of a CDQC acting on vector-states are dual,and in the finite dimensional case,it is proved that the divider and the combiner of a CDQC acting on operator-states(matrix-states) are also dual.Lastly,the loss of an input state passing through a CDQC is measured.展开更多
We consider a subclass of quantum Turing machines (QTM), named stationary rotational quantum Turing machine (SR-QTM), which halts deterministically and has deterministic tape head position. A quantum state transition ...We consider a subclass of quantum Turing machines (QTM), named stationary rotational quantum Turing machine (SR-QTM), which halts deterministically and has deterministic tape head position. A quantum state transition diagram (QSTD) is proposed to describe SR-QTM. With QSTD, we construct a SR-QTM which is universal for all near-trivial transformations. This indicates there exists a QTM which is universal for the above subclass. Finally we show that SR-QTM is computational equivalent with ordinary QTM in the bounded error setting. It can be seen that SR-QTMs have deterministic tape head position and halt deterministically, and thus the halting scheme problem will not exist for this class of QTMs.展开更多
The query model(or black-box model)has attracted much attention from the communities of both classical and quantum computing.Usually,quantum advantages are revealed by presenting a quantum algorithm that has a better ...The query model(or black-box model)has attracted much attention from the communities of both classical and quantum computing.Usually,quantum advantages are revealed by presenting a quantum algorithm that has a better query complexity than its classical counterpart.In the history of quantum algorithms,the Deutsch algorithm and the Deutsch-Jozsa algorithm play a fundamental role and both are exact one-query quantum algorithms.This leads us to con-sider the problem:what functions can be computed by exact one-query quantum algorithms?This problem has been ad-dressed in the literature for total Boolean functions and symmetric partial Boolean functions,but is still open for general partial Boolean functions.Thus,in this paper,we continue to characterize the computational power of exact one-query quantum algorithms for general partial Boolean functions.First,we present several necessary and sufficient conditions for a partial Boolean function to be computed by exact one-query quantum algorithms.Second,inspired by these conditions,we discover some new representative functions that can be computed by exact one-query quantum algorithms but have an essential difference from the already known ones.Specially,it is worth pointing out that before our work,the known func-tions that can be computed by exact one-query quantum algorithms are all symmetric functions and the quantum algo-rithm used is essentially the Deutsch-Jozsa algorithm,whereas the functions discovered in this paper are generally asym-metric and new algorithms to compute these functions are required.Thus,this expands the class of functions that can be computed by exact one-query quantum algorithms.展开更多
基金4 Acknowledgements The author would like to thank G.L. Long for very helpful discussion, and thank J.Q. Yi for his generous help in plotting the function figures.
文摘An important and usual sort of search problems is to find all marked states from an unsorted database with a large number of states. Grover's original quantum search algorithm is for finding single marked state with uncertainty, and it has been generalized to the case of multiple marked states, as well as been modified to find single marked state with certainty. However, the query complexity for finding all multiple marked states has not been addressed. We use a generalized Long's algorithm with high precision to solve such a problem. We calculate the approximate query complexity, which increases with the number of marked states and with the precision that we demand. In the end we introduce an algorithm for the problem on a "duality computer" and show its advantage over other algorithms.
基金supported by the National Natural Science Foundation of China(No.21476119)
文摘The title complex is widely used as an efficient key component of Ziegler-Natta catalyst for stereospecific polymerization of dienes to produce synthetic rubbers. However, the quantitative structure-activity relationship(QSAR) of this kind of complexes is still not clear mainly due to the difficulties to obtain their geometric molecular structures through laboratory experiments. An alternative solution is the quantum chemistry calculation in which the comformational population shall be determined. In this study, ten conformers of the title complex were obtained with the function of molecular dynamics conformational search in Gabedit 2.4.8, and their geometry optimization and thermodynamics calculation were made with a Sparkle/PM7 approach in MOPAC 2012. Their Gibbs free energies at 1 atm. and 298.15 K were calculated. Population of the conformers was further calculated out according to the theory of Boltzmann distribution, indicating that one of the ten conformers has a dominant population of 77.13%.
文摘This work proposes quantum circuit complexity—the minimal number of elementary operations needed to implement a quantum transformation—be established as a legitimate physical observable. We prove that circuit complexity satisfies all requirements for physical observables, including self-adjointness, gauge invariance, and a consistent measurement theory with well-defined uncertainty relations. We develop complete protocols for measuring complexity in quantum systems and demonstrate its connections to gauge theory and quantum gravity. Our results suggest that computational requirements may constitute physical laws as fundamental as energy conservation. This framework grants insights into the relationship between quantum information, gravity, and the emergence of spacetime geometry while offering practical methods for experimental verification. Our results indicate that the physical universe may be governed by both energetic and computational constraints, with profound implications for our understanding of fundamental physics.
基金Support of the grant MSM00211622419 is to be acknowledge
文摘Quantum information processing and communication(QIPC) is an area of science that has two main goals: On one side,it tries to explore(still not well known) potential of quantum phenomena for(efficient and reliable) information processing and(efficient,reliable and secure) communication.On the other side,it tries to use quantum information storing,processing and transmitting paradigms,principles,laws,limitations,concepts,models and tools to get deeper insights into the phenomena of quantum world and to find efficient ways to describe and handle/simulate various complex physical phenomena.In order to do that QIPC has to use concepts,models,theories,methods and tools of both physics and informatics.The main role of physics at that is to discover primitive physical phenomena that can be used to design and maintain complex and reliable information storing,processing and transmitting systems.The main role of informatics is,one one side,to explore,from the information processing and communication point of view,limitations and potentials of the potential quantum information processing and communication technology,and to prepare information processing methods that could utilise potential of quantum information processing and communication technologies.On the other side,the main role of informatics is to guide and support,by theoretical tools and outcomes,physics oriented research in QIPC.The paper is to describe and analyse a variety of ways and potential informatics contributes and should/could contribute to the development of QIPC--see also Gruska(1999,2006,2008).
基金National Natural Science Foundation of China(Grant Nos.62272492,61772565)Guangdong Basic and Applied Basic Research Foundation(No.2020B1515020050).
文摘Matroid theory has been developed to be a mature branch of mathematics and has extensive applications in combinatorial optimization,algorithm design and so on.On the other hand,quantum computing has attracted much attention and has been shown to surpass classical computing on solving some computational problems.Surprisingly,crossover studies of the two fields seem to be missing in the literature.This paper initiates the study of quantum algorithms for matroid property problems.It is shown that quadratic quantum speedup is possible for the calculation problem of finding the girth or the number of circuits(bases,flats,hyperplanes)of a matroid,and for the decision problem of deciding whether a matroid is uniform or Eulerian,by giving a uniform lower boundΩ■on the query complexity of all these problems.On the other hand,for the uniform matroid decision problem,an asymptotically optimal quantum algorithm is proposed which achieves the lower bound,and for the girth problem,an almost optimal quantum algorithm is given with query complexityO■.In addition,for the paving matroid decision problem,a lower boundΩ■on the query complexity is obtained,and an O■ quantum algorithm is presented.
基金supported by the National Natural Science Foundation of China (Grant Nos. 10571113 and 11171197)the Fundamental Research Funds for the Central Universities (Grant No. GK201002006)
文摘The aim of this paper is to establish a mathematical fundamental of complex duality quantum computers(CDQCs) acting on vector-states(pure states) and operator-states(mixed states),respectively.A CDQC consists of a complex divider,a group of quantum gates represented by unitary operators,or quantum operations represented by completely positive and trace-preserving mappings,and a complex combiner.It is proved that the divider and the combiner of a CDQC are an isometry and a contraction,respectively.It is proved that the divider and the combiner of a CDQC acting on vector-states are dual,and in the finite dimensional case,it is proved that the divider and the combiner of a CDQC acting on operator-states(matrix-states) are also dual.Lastly,the loss of an input state passing through a CDQC is measured.
基金supported by the National Natural Science Foundation of China (Grant No.61173157)the Strategy Pilot Project of Chinese Academy of Sciences (Grant No.project XDA06010702)IIE’s Cryptography Research Project
文摘We consider a subclass of quantum Turing machines (QTM), named stationary rotational quantum Turing machine (SR-QTM), which halts deterministically and has deterministic tape head position. A quantum state transition diagram (QSTD) is proposed to describe SR-QTM. With QSTD, we construct a SR-QTM which is universal for all near-trivial transformations. This indicates there exists a QTM which is universal for the above subclass. Finally we show that SR-QTM is computational equivalent with ordinary QTM in the bounded error setting. It can be seen that SR-QTMs have deterministic tape head position and halt deterministically, and thus the halting scheme problem will not exist for this class of QTMs.
基金supported by the National Natural Science Foundation of China under Grant Nos.61772565 and 62272492the Guangdong Basic and Applied Basic Research Foundation under Grant No.2020B1515020050the Key Research and Development Program of Guangdong Province of China under Grant No.2018B030325001.
文摘The query model(or black-box model)has attracted much attention from the communities of both classical and quantum computing.Usually,quantum advantages are revealed by presenting a quantum algorithm that has a better query complexity than its classical counterpart.In the history of quantum algorithms,the Deutsch algorithm and the Deutsch-Jozsa algorithm play a fundamental role and both are exact one-query quantum algorithms.This leads us to con-sider the problem:what functions can be computed by exact one-query quantum algorithms?This problem has been ad-dressed in the literature for total Boolean functions and symmetric partial Boolean functions,but is still open for general partial Boolean functions.Thus,in this paper,we continue to characterize the computational power of exact one-query quantum algorithms for general partial Boolean functions.First,we present several necessary and sufficient conditions for a partial Boolean function to be computed by exact one-query quantum algorithms.Second,inspired by these conditions,we discover some new representative functions that can be computed by exact one-query quantum algorithms but have an essential difference from the already known ones.Specially,it is worth pointing out that before our work,the known func-tions that can be computed by exact one-query quantum algorithms are all symmetric functions and the quantum algo-rithm used is essentially the Deutsch-Jozsa algorithm,whereas the functions discovered in this paper are generally asym-metric and new algorithms to compute these functions are required.Thus,this expands the class of functions that can be computed by exact one-query quantum algorithms.