Overlapped embedded fragment stochastic density functional theory for covalently-bonded materials von Chen, Ming, Baer, Roi, Neuhauser, Daniel, Rabani, Eran

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Weak second-order quantum state diffusion unraveling of the Lindblad master equation von Adhikari, Sayak, Baer, Roi

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Energy window stochastic density functional theory von Chen, Ming, Baer, Roi, Neuhauser, Daniel, Rabani, Eran

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Tuned range-separated hybrids in density functional theory von Baer, Roi, Livshits, Ester, Salzner, Ulrike

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Reliable Prediction of Charge Transfer Excitations in Molecular Complexes Using Time-Dependent Density Functional Theory von Stein, Tamar, Kronik, Leeor, Baer, Roi

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Structure optimization with stochastic density functional theory von Chen, Ming, Baer, Roi, Rabani, Eran

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Communication: Embedded fragment stochastic density functional theory von Neuhauser, Daniel, Baer, Roi, Rabani, Eran

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Koopmans' springs to life von Salzner, Ulrike, Baer, Roi

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High-frequency limit of spectroscopy von Nazarov, Vladimir U., Baer, Roi

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Revisiting the benzene excimer using [2,2] paracyclophane model system: Experiment and theory von Haggag, Omer, Baer, Roi, Ruhman, Sanford, Krylov, Anna I.

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Stochastic embedding DFT: Theory and application to p-nitroaniline in water von Li, Wenfei, Chen, Ming, Rabani, Eran, Baer, Roi, Neuhauser, Daniel

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Sublinear scaling for time-dependent stochastic density functional theory von Gao, Yi, Neuhauser, Daniel, Baer, Roi, Rabani, Eran

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Sequential and concerted C–C and C–O bond dissociation in the Coulomb explosion of 2-propanol von Bittner, Dror M., Gope, Krishnendu, Livshits, Ester, Baer, Roi, Strasser, Daniel

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Equilibrium configurations of large nanostructures using the embedded saturated-fragments stochastic density functional theory von Arnon, Eitam, Rabani, Eran, Neuhauser, Daniel, Baer, Roi

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Range-separated stochastic resolution of identity: Formulation and application to second-order Green’s function theory von Dou, Wenjie, Chen, Ming, Takeshita, Tyler Y., Baer, Roi, Neuhauser, Daniel, Rabani, Eran

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Theory of multiexciton generation in semiconductor nanocrystals von Rabani, Eran, Baer, Roi

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Efficient Langevin dynamics for “noisy” forces von Arnon, Eitam, Rabani, Eran, Neuhauser, Daniel, Baer, Roi

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Tempering stochastic density functional theory von Nguyen, Minh, Li, Wenfei, Li, Yangtao, Rabani, Eran, Baer, Roi, Neuhauser, Daniel

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Stochastic resolution of identity second-order Matsubara Green’s function theory von Takeshita, Tyler Y., Dou, Wenjie, Smith, Daniel G. A., de Jong, Wibe A., Baer, Roi, Neuhauser, Daniel, Rabani, Eran

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Distribution of Multiexciton Generation Rates in CdSe and InAs Nanocrystals von Rabani, Eran, Baer, Roi

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