Many-Body Quantum Monte Carlo Study of 2D Materials: Cohesion and Band Gap in Single-Layer Phosphorene
Frank, T., Derian, R., Tokár, K., Mitas, L., Fabian, J., Štich, I.
Published in Physical review. X (01.01.2019)
Published in Physical review. X (01.01.2019)
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Optical Gaps in Pristine and Heavily Doped Silicon Nanocrystals: DFT versus Quantum Monte Carlo Benchmarks
Derian, R, Tokár, K, Somogyi, B, Gali, Á, Štich, I
Published in Journal of chemical theory and computation (12.12.2017)
Published in Journal of chemical theory and computation (12.12.2017)
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Disentanglement of triplet and singlet states of azobenzene: direct EELS detection and QMC modeling
Dubecký, M, Derian, R, Horváthová, L, Allan, M, Štich, I
Published in Physical chemistry chemical physics : PCCP (01.01.2011)
Published in Physical chemistry chemical physics : PCCP (01.01.2011)
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Generalized DMPK equation for strongly localized regime - numerical solution
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