Quantum computational chemistry

Cites (415)

Items 201–400 of 511

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3. Resource-efficient quantum algorithm for protein folding
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4. Chemical basis of Trotter-Suzuki errors in quantum chemistry simulation
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5. Nearly Optimal Lattice Simulation by Product Formulas
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6. Mapping local Hamiltonians of fermions to local Hamiltonians of spins
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7. Quantum Information and Computation for Chemistry
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8. A unitary multiconfigurational coupled-cluster method: Theory and applications
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9. Adiabatic Quantum Simulation of Quantum Chemistry
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10. Efficient quantum measurement of Pauli operators in the presence of finite sampling error
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11. Faster ground state preparation and high-precision ground energy estimation with fewer qubits
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12. A Multireference Quantum Krylov Algorithm for Strongly Correlated Electrons
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13. An introduction to measurement based quantum computation
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14. Experimental Bayesian Quantum Phase Estimation on a Silicon Photonic Chip
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16. Increasing the Representation Accuracy of Quantum Simulations of Chemistry without Extra Quantum Resources
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17. Quantum Algorithms to Simulate Many-Body Physics of Correlated Fermions
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18. Quantum phase estimation of multiple eigenvalues for small-scale (noisy) experiments
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19. Improved Fault-Tolerant Quantum Simulation of Condensed-Phase Correlated Electrons via Trotterization
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20. Low rank representations for quantum simulation of electronic structure
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21. Density matrix renormalization group for ab initio Calculations and associated dynamic correlation methods: A review of theory and applications
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22. Iterative Qubit Coupled Cluster Approach with Efficient Screening of Generators
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23. Is the Trotterized UCCSD Ansatz Chemically Well-Defined?
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24. Quantum orbital-optimized unitary coupled cluster methods in the strongly correlated regime: Can quantum algorithms outperform their classical equivalents?
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25. Improved techniques for preparing eigenstates of fermionic Hamiltonians
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26. Quantum machine learning for electronic structure calculations
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27. Methodology of Resonant Equiangular Composite Quantum Gates
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28. The Trotter step size required for accurate quantum simulation of quantum chemistry
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29. Quantum computation with realistic magic-state factories
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30. Efficient Multiphoton Sampling of Molecular Vibronic Spectra on a Superconducting Bosonic Processor
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31. Simulations of Many-Body Quantum Systems by a Quantum Computer
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32. Quantum Simulation of Helium Hydride Cation in a Solid-State Spin Register
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33. The Matter Simulation (R)evolution
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34. Application of fermionic marginal constraints to hybrid quantum algorithms
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35. Gate-Efficient Simulation of Molecular Eigenstates on a Quantum Computer
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36. Efficient magic state factories with a catalyzed | C C Z ⟩ to 2 | T ⟩ transformation
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37. Proceedings of the twenty-ninth annual ACM symposium on Theory of computing
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38. Decoding quantum errors with subspace expansions
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39. A deterministic alternative to the full configuration interaction quantum Monte Carlo method
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40. Faster quantum chemistry simulation on fault-tolerant quantum computers
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41. Selected new developments in vibrational structure theory: potential construction and vibrational wave function calculations
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42. Benchmark variational coupled cluster doubles results
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43. Quantum Overlapping Tomography
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44. Methodology for replacing indirect measurements with direct measurements
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45. A Comparison of the Bravyi–Kitaev and Jordan–Wigner Transformations for the Quantum Simulation of Quantum Chemistry
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46. Quantum eigenvalue estimation via time series analysis
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47. Quantum localization bounds Trotter errors in digital quantum simulation
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48. Experimental error mitigation via symmetry verification in a variational quantum eigensolver
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49. Analogue quantum chemistry simulation
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50. Exponentially more precise quantum simulation of fermions in second quantization
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51. Fault-tolerant thresholds for quantum error correction with the surface code
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52. The B ravyi– K itaev transformation: Properties and applications
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53. Approaching chemical accuracy using full configuration-interaction quantum Monte Carlo: A study of ionization potentials
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54. Reducing Qubit Requirements for Quantum Simulations Using Molecular Point Group Symmetries
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55. Superfast encodings for fermionic quantum simulation
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56. Quantum computation with universal error mitigation on a superconducting quantum processor
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57. Using Quantum Computers for Quantum Simulation
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58. A non-orthogonal variational quantum eigensolver
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59. Exploiting Locality in Quantum Computation for Quantum Chemistry
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60. Is quantum mechanics useful?
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61. Complexity Classification of Local Hamiltonian Problems
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62. Black-box hamiltonian simulation and unitary implementation
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63. The electronic complexity of the ground-state of the FeMo cofactor of nitrogenase as relevant to quantum simulations
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64. Measurement reduction in variational quantum algorithms
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65. Quantum simulation of chemistry with sublinear scaling in basis size
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66. Construction of model Hamiltonians for adiabatic quantum computation and its application to finding low-energy conformations of lattice protein models
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67. Electron-Phonon Systems on a Universal Quantum Computer
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68. Constrained Variational Quantum Eigensolver: Quantum Computer Search Engine in the Fock Space
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69. Low-depth circuit ansatz for preparing correlated fermionic states on a quantum computer
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70. Extending the computational reach of a noisy superconducting quantum processor
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71. Bravyi-Kitaev Superfast simulation of electronic structure on a quantum computer
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72. Re-Engineering the Design Process Through Computation
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73. Orbital optimized unitary coupled cluster theory for quantum computer
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74. Calculating the thermal rate constant with exponential speedup on a quantum computer
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75. Error-mitigated quantum gates exceeding physical fidelities in a trapped-ion system
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76. Generalized swap networks for near-term quantum computing
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77. Minimizing State Preparations in Variational Quantum Eigensolver by Partitioning into Commuting Families
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78. New Approaches for ab initio Calculations of Molecules with Strong Electron Correlation
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79. Simulating quantum dynamics on a quantum computer
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80. Optimal fermion-to-qubit mapping via ternary trees with applications to reduced quantum states learning
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81. Quantum algorithm for obtaining the energy spectrum of molecular systems
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82. Gate-Efficient Simulation of Molecular Eigenstates on a Quantum Computer
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83. Quantum Algorithm for Spectral Measurement with a Lower Gate Count
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84. Digital quantum simulation of molecular vibrations
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85. Calculating energy derivatives for quantum chemistry on a quantum computer
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86. Black-Box Quantum State Preparation without Arithmetic
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87. Polynomial-Time Simulation of Pairing Models on a Quantum Computer
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88. Decoding quantum errors with subspace expansions
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89. $O(N^3)$ Measurement Cost for Variational Quantum Eigensolver on Molecular Hamiltonians
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90. Jastrow-type Decomposition in Quantum Chemistry for Low-Depth Quantum Circuits
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91. $O(N^3)$ Measurement Cost for Variational Quantum Eigensolver on Molecular Hamiltonians
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92. Electronic Structure Calculations and the Ising Hamiltonian
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93. Practical optimization for hybrid quantum-classical algorithms
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94. Quantum localization bounds Trotter errors in digital quantum simulation
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95. Robust determination of molecular spectra on a quantum processor
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96. Digital quantum computation of fermion-boson interacting systems
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98. Operator locality in the quantum simulation of fermionic models
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99. Adiabatic state preparation study of methylene
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100. Quantum Chemistry on Quantum Computers: A Method for Preparation of Multiconfigurational Wave Functions on Quantum Computers without Performing Post-Hartree–Fock Calculations
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101. Exponentially more precise quantum simulation of fermions in the configuration interaction representation
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102. Mapping local Hamiltonians of fermions to local Hamiltonians of spins
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103. Bounding the costs of quantum simulation of many-body physics in real space
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104. Quantum Algorithm for Calculating Molecular Vibronic Spectra
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105. Optimizing quantum heuristics with meta-learning
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107. Resource Estimation for Quantum Variational Simulations of the Hubbard Model
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108. Optimizing quantum heuristics with meta-learning
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110. Subspace variational quantum simulator
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111. Theory of analytical energy derivatives for the variational quantum eigensolver
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112. Quantum algorithm for obtaining the energy spectrum of molecular systems
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113. Quantum optical emulation of molecular vibronic spectroscopy using a trapped-ion device
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114. Nearly Optimal Measurement Scheduling for Partial Tomography of Quantum States
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115. Dynamical mean field theory algorithm and experiment on quantum computers
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116. Mitigating algorithmic errors in a Hamiltonian simulation
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117. Computational complexity in electronic structure
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118. Local spin operators for fermion simulations
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119. A quantum alternating operator ansatz with hard and soft constraints for lattice protein folding
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120. Low overhead quantum computation using lattice surgery
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121. Demonstration of Adiabatic Variational Quantum Computing with a Superconducting Quantum Coprocessor
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122. A Jacobi Diagonalization and Anderson Acceleration Algorithm For Variational Quantum Algorithm Parameter Optimization
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123. A full-configuration benchmark for the N2 molecule
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124. Simulating the dynamics of time-dependent Hamiltonians with a truncated Dyson series
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125. Compilation by stochastic Hamiltonian sparsification
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126. Observation of ten-photon entanglement using thin BiB_3O_6 crystals
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127. Majorana Loop Stabilizer Codes for Error Mitigation in Fermionic Quantum Simulations
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128. Solving Quantum Ground-State Problems with Nuclear Magnetic Resonance
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129. Vibronic Boson Sampling: Generalized Gaussian Boson Sampling for Molecular Vibronic Spectra at Finite Temperature
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130. Quantum codes for quantum simulation of fermions on a square lattice of qubits
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131. Recovering noise-free quantum observables
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132. Introduction to Quantum Algorithms for Physics and Chemistry
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133. Quantum-classical simulation of two-site dynamical mean-field theory on noisy quantum hardware
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134. Quantum Chemistry on Quantum Computers: A Polynomial-Time Quantum Algorithm for Constructing the Wave Functions of Open-Shell Molecules
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135. Finding the ground state of the Hubbard model by variational methods on a quantum computer with gate errors
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136. Preparation of many-body states for quantum simulation
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137. Key ideas in quantum error correction
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138. Majorana-Based Fermionic Quantum Computation
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142. Accounting for errors in quantum algorithms via individual error reduction
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144. Efficient quantum algorithm for preparing molecular-system-like states on a quantum computer
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145. Coarse-grained lattice protein folding on a quantum annealer
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146. Construction of Energy Functions for Lattice Heteropolymer Models: Efficient Encodings for Constraint Satisfaction Programming and Quantum Annealing
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147. Pauli Partitioning with Respect to Gate Sets
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148. Postponing the orthogonality catastrophe: efficient state preparation for electronic structure simulations on quantum devices
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149. Quantum chemistry simulation on quantum computers: theories and experiments
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151. Error detection on quantum computers improving the accuracy of chemical calculations
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