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21 lines
2.2 KiB
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21 lines
2.2 KiB
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Research made with the Quantum Package
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- A Mountaineering Strategy to Excited States: Highly Accurate Reference Energies and Benchmarks :cite:`Loos_2018`
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- Deterministic Construction of Nodal Surfaces within Quantum Monte Carlo: The Case of {FeS} :cite:`Scemama_2018`
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- Excitation energies from diffusion Monte Carlo using selected configuration interaction nodes :cite:`Scemama_2018.2`
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- Perturbatively Selected Configuration-Interaction Wave Functions for Efficient Geometry Optimization in Quantum Monte Carlo :cite:`Dash_2018`
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- Selected configuration interaction dressed by perturbation :cite:`Garniron_2018`
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- A Jeziorski-Monkhorst fully uncontracted multi-reference perturbative treatment. I. Principles, second-order versions, and tests on ground state potential energy curves :cite:`Giner_2017`
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- Alternative definition of excitation amplitudes in multi-reference state-specific coupled cluster :cite:`Garniron_2017`
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- Hybrid stochastic-deterministic calculation of the second-order perturbative contribution of multireference perturbation theory :cite:`Garniron_2017.2`
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- Orthogonal Valence Bond Hamiltonians incorporating dynamical correlation effects :cite:`Giner_2017.2`
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- A simple approach to the state-specific {MR}-{CC} using the intermediate Hamiltonian formalism :cite:`Giner_2016`
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- Communication: Toward an improved control of the fixed-node error in quantum Monte Carlo: The case of the water molecule :cite:`Caffarel_2016`
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- Using CIPSI Nodes in Diffusion Monte Carlo :cite:`Caffarel_2016.2`
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- Fixed-node diffusion Monte Carlo potential energy curve of the fluorine molecule F2 using selected configuration interaction trial wavefunctions :cite:`Giner_2015`
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- Accurate nonrelativistic ground-state energies of 3d transition metal atoms :cite:`Scemama_2014`
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- Spin Density Distribution in Open-Shell Transition Metal Systems: A Comparative Post-Hartree-Fock, Density Functional Theory, and Quantum Monte Carlo Study of the CuCl2 Molecule :cite:`Caffarel_2014`
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- Using perturbatively selected configuration interaction in quantum Monte Carlo calculations :cite:`Giner_2013`
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- An efficient implementation of Slater-Condon rules :cite:`Scemama2013Nov`
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