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bib=M. Grumet, P. Liu, M. Kaltak, J. Klimeš, and G. Kresse, Phys. Rev. B '''98''', 155143 (2018).| | bib=M. Grumet, P. Liu, M. Kaltak, J. Klimeš, and G. Kresse, Phys. Rev. B '''98''', 155143 (2018).| | ||
link=https://doi.org/10.1103/PhysRevB.98.155143 | link=https://doi.org/10.1103/PhysRevB.98.155143 | ||
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bib=M. Grumet, Thesis: Self-consistent GW calculations for solids(2017).| | |||
link=https://utheses.univie.ac.at/detail/43403# | |||
}}{{ | }}{{ | ||
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bib=Ph. Ghosez, J.-P. Michenaud, and X. Gonze, ''Dynamical atomic charges: The case of ABO3 compounds'', Phys. Rev. B '''58''', 6224 (1998).| | bib=Ph. Ghosez, J.-P. Michenaud, and X. Gonze, ''Dynamical atomic charges: The case of ABO3 compounds'', Phys. Rev. B '''58''', 6224 (1998).| | ||
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Reference|key=engel:prb:2020|show={{{1}}}| | |||
bib=M. Engel, M. Marsman, C. Franchini, and G. Kresse, ''Electron-phonon interactions using the projector augmented-wave method and Wannier functions'', Phys. Rev. B '''101''', 184302 (2020).| | |||
link=https://doi.org/10.1103/PhysRevB.101.184302 | |||
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bib= triqs.github.io/solid_dmft/tutorials/PrNiO3_csc_vasp_plo_cthyb/tutorial (2024).| | bib= triqs.github.io/solid_dmft/tutorials/PrNiO3_csc_vasp_plo_cthyb/tutorial (2024).| | ||
link=https://triqs.github.io/solid_dmft/tutorials/PrNiO3_csc_vasp_plo_cthyb/tutorial.html | link=https://triqs.github.io/solid_dmft/tutorials/PrNiO3_csc_vasp_plo_cthyb/tutorial.html | ||
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Reference|key=hratchian:schlegel:2005|show={{{1}}}| | |||
bib= H. Hratchian, H. Schlegel, Theory and Application of Computational Chemistry, Chapter 10 - Finding minima, transition states, and following reaction pathways on ab initio potential energy surfaces (2005), p. 195-249| | |||
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}} | }} |
Latest revision as of 12:46, 5 November 2024
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