Institute of Molecular Science and Technologies

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20032024

most citedRelativistic Solar Cells

1.3k citations

Showing 2016Show all

3 papers · 1 filter

cond-mat.supr-con2016★ 63 cited

Direct observation of charge order in underdoped and optimally doped Bi $_{2}$ (Sr,La) $_{2}$ CuO $_{6 + δ}$ by resonant inelastic x-ray scattering

Y. Y. Peng, M. Salluzzo, X. Sun +10

Charge order in underdoped and optimally doped high- $T_{c}$ superconductors Bi $_{2}$ Sr $_{2 - x}$ La $_{x}$ CuO $_{6 + δ}$ (Bi2201) is investigated by Cu $L_{3}$ edge resonant inelastic…

physics.comp-ph2016★ 29 cited

Elastic constants and thermodynamics properties of pristine PEDOT revealed: A first-principles PBE/PBE PAW approach

R. O. Agbaoye, P. O. Adebambo, J. O. Akinlami +4

In this work, we report for the first time, detailed calculations of elastic and thermodynamic properties of organic poly(3,4-ethylenedioxythiophene), PEDOT, in an undiluted state,…

cond-mat.mtrl-sci2016★ 59 cited

Accurate Tight-Binding Hamiltonians for 2D and Layered Materials

Luis Agapito, Marco Fornari, Davide Ceresoli +3

We present a scheme to controllably improve the accuracy of tight-binding Hamiltonian matrices derived by projecting the solutions of plane-wave ab initio calculations on atomic or…

Direct observation of charge order in underdoped and optimally doped Bi2​(Sr,La)2​CuO6+δ​ by resonant inelastic x-ray scattering

Elastic constants and thermodynamics properties of pristine PEDOT revealed: A first-principles PBE/PBE PAW approach

Accurate Tight-Binding Hamiltonians for 2D and Layered Materials

Direct observation of charge order in underdoped and optimally doped Bi $_{2}$ (Sr,La) $_{2}$ CuO $_{6 + δ}$ by resonant inelastic x-ray scattering