Results 231 to 240 of about 19,135,649 (331)

Crystallographic, electronic and vibrational properties of 2D silicate monolayers

open access: yesJournal of Applied Crystallography, Volume 58, Issue 2, Page 349-362, April 2025.
The present work reports a density functional theory investigation of the structural, electronic, Raman and infrared properties of the (001) monolayer of phlogopite [K(Mg,Fe)3Si3AlO10(OH)2, with Mg/Fe ratio ≥ 2] and how they change with different Fe2+/Mg2+ substitutions in the octahedral sheet.Phyllosilicates are promising materials for optoelectronic ...
Gianfranco Ulian, Giovanni Valdrè
wiley   +1 more source

Synthesis and quantum crystallographic evaluation of WYLID: YLID's red rival

open access: yesJournal of Applied Crystallography, Volume 58, Issue 3, Page 678-687, June 2025.
The synthesis and quantum crystallographic analysis of the chemical bonding within WYLID, 2‐(dimethyl‐λ4‐sulfaneylidene)‐[1,2′‐biindenylidene]‐1′,3,3′(2H)‐trione, a condensation product of YLID which is the most widely used calibrant for laboratory diffractometers, is presented.
Florian Meurer   +6 more
wiley   +1 more source

Toward brain-computer interface speller with movement-related cortical potentials as control signals. [PDF]

open access: yesFront Hum Neurosci
Hernández-Gloria JJ   +3 more
europepmc   +1 more source

Forward‐model‐based grain reconstruction to improve the tolerance of diffraction contrast tomography for increased sample deformation

open access: yesJournal of Applied Crystallography, Volume 58, Issue 3, Page 796-812, June 2025.
A novel forward‐model‐based reconstruction method has been developed for diffraction contrast tomography and has shown great promise in increasing the tolerance of this technique for increased sample deformation. This method is suitable for multi‐phase reconstruction under both box‐beam and line‐beam acquisition geometries and can reconstruct ...
Haixing Fang, Wolfgang Ludwig
wiley   +1 more source

Positive solutions for classes of $p$-Laplacian equations [PDF]

open access: bronze, 2003
Maya Chhetri   +2 more
openalex   +1 more source

Multipolar model and Hirshfeld atom refinement of tetraaquabis(hydrogenmaleato)iron(II)

open access: yesActa Crystallographica Section B, EarlyView.
Multipolar model and Hirshfeld atom refinement are conducted on tetraaquabis(hydrogenmaleato)iron(II) based on a high‐resolution X‐ray diffraction experiment. Topological analysis is performed on both models. The study evaluates these models by comparing their effectiveness in determining bond lengths, anisotropic displacement parameters, electron ...
Hellen Ferreira Guimarães   +1 more
wiley   +1 more source

Home - About - Disclaimer - Privacy