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Quantum computation for chemical problems will require the construction of guiding states with sufficient overlap with a target state.
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Aharonov, D.; Jones, V.; Landau, Z. A Polynomial Quantum Algorithm for Approximating the Jones Polynomial. Algorithmica 2009
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Harrow, A. W.; Hassidim, A.; Lloyd, S. Quantum algorithm for linear systems of equations. Phys. Rev. Lett. 2009
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Aharonov, D.; Gottesman, D.; Irani, S.; Kempe, J. The Power of Quantum Systems on a Line. Commun. Math. Phys. 2009
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Li, Z.; Guo, S.; Sun, Q.; Chan, G. K.-L. Electronic landscape of the P-cluster of nitrogenase as revealed through many-electron quantum wavefunction simulations. Nature Chem. 2019
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Grimme, S.; Ehrlich, S.; Goerigk, L. Effect of the damping function in dispersion corrected density functional theory. J. Comput. Chem. 2011
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Spatzal, T.; Aksoyoglu, M.; Zhang, L.; Andrade, S. L. A.; Schleicher, E.; Weber, S.; Rees, D. C.; Einsle, O. Evidence for Interstitial Carbon in Nitrogenase FeMo Cofactor. Science 2011
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2020
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2021
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2021
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