Results 131 to 140 of about 3,465,058 (176)

Aromaticity of Substituted Benzene Derivatives Employing a New Set of Aromaticity Descriptors Based on the Partition of Electron Density. [PDF]

J Comput Chem
Máximo-Canadas M, Rosa NMP, Borges I.
europepmc   +1 more source

How well do various QM-derived net atomic charges reproduce the electrostatic potential surrounding a material across multiple geometric conformations? [PDF]

RSC Adv
Escobosa AC, Manz TA.
europepmc   +1 more source

Six-Fold Methyl Internal Rotation and ¹⁴N Nuclear Quadrupole Coupling in the Microwave Spectra of <i>N</i>-Methylmaleimide and <i>N</i>-Methylsuccinimide. [PDF]

J Phys Chem A
Khemissi S, Tiu CA, Kleiner I, Nguyen HVL, Crabtree KN, Hernandez-Castillo AO.   +5 more
europepmc   +1 more source

A New Set of Aromaticity Descriptors Based on the Electron Density Employing the Distributed Multipole Analysis (DMA). [PDF]

ACS Omega
Máximo-Canadas M, Oliveira RSS, Oliveira MAS, Borges I.   +3 more
europepmc   +1 more source

Chirality-Enhanced Two-Photon Absorption with Asymmetric Vortex Beams in Twisted Gold Nanorods

Kotov N, Daafour J, Ni B, Bassene P, Law C, N'gom M.   +5 more
europepmc   +1 more source

Differentiating Between Enantiomers with Nuclear Quadrupole Coupling Using Microwave Three-Wave Mixing. [PDF]

J Phys Chem Lett
Berggötz FEL, Leibscher M, Sun W, Koch CP, Schnell M.   +4 more
europepmc   +1 more source

Ambiguities in Assigning Single-Crystal NMR Data to Individual Atoms in the Crystal Structure: A Case Study of Hambergite, Be₂BO₃OH, by ⁹Be and ¹¹B NMR Spectroscopy, XRD Measurements and DFT Calculations. [PDF]

Magn Reson Chem
Steinadler J, Krach G, Witthaut K, Stürzer T, Hochleitner R, Schnick W, Bräuniger T.   +6 more
europepmc   +1 more source

Investigations of spin textures at small length and short timescales with neutron, x-ray, and optical methods. [PDF]

Sci Adv
Fischer P, Broholm C, Tam CC, Wilson SD, Rasing T, Kimel AV.   +5 more
europepmc   +1 more source

Orbital angular momentum control of strong-field ionization in atoms and molecules. [PDF]

Nat Commun
Bégin JL, Karimi E, Corkum P, Brabec T, Bhardwaj R.   +4 more
europepmc   +1 more source

Nanometer-scale confinement of whispering gallery plasmonic modes upon slit excitation. [PDF]

Nanoscale Adv
Parsamyan H, Gabrielyan R, Arabajyan G, Haroyan H, Nerkararyan K.   +4 more
europepmc   +1 more source