Results 121 to 130 of about 700,935 (209)

X-ray electron density analysis of chemical bonding in permanent magnet Nd₂Fe₁₄B. [PDF]

IUCrJ
Vosegaard ES, Svane J, Brummerstedt Iversen B.   +2 more
europepmc   +1 more source

Advanced Molecular Electron Density Theory Study of the Substituent Effects in Nucleophilic Substitution Reactions. [PDF]

ACS Omega
Domingo LR, Pérez P, Ríos-Gutiérrez M, Aurell MJ.   +3 more
europepmc   +1 more source

Accuracy of Photon Dose Calculation on Photon-Counting Computed Tomography-A Comparison Study Based on Virtual Monoenergetic and Electron Density (Rho) Images for Pancreatic Cases. [PDF]

Adv Radiat Oncol
Wu X, Wohlfahrt P, Shah J, Lofino L, Palta M, Wu Q, Wu QJ, Sheng Y.   +7 more
europepmc   +1 more source

Dual-energy computed tomography-derived electron density in the differential diagnosis of focal hepatic lesions: initial experience. [PDF]

Quant Imaging Med Surg
Ohtani T, Ozaki K, Ishida T, Takahashi K, Shimada M, Kanai S, Wakabayashi T, Takata K, Tateishi T, Tsujikawa T.   +9 more
europepmc   +1 more source

Intramolecular Versus Intermolecular Diels-Alder Reactions: Insights from Molecular Electron Density Theory. [PDF]

Molecules
Domingo LR, Pérez P.
europepmc   +1 more source

Unscreened Polaron Ordering Against High Electron Density on Mechanically Cleaved Surfaces of WO₃ (001) Films. [PDF]

Small
Lee G, Seo J, Yang W, Mun JH, Kang M, Nahm HH, Kim YH, Kim TH, Yang CH, Kim Y.   +9 more
europepmc   +1 more source

Reconstruction of the On-Top Two-Electron Density from Natural Orbitals and Their Occupation Numbers. [PDF]

J Chem Theory Comput
Cioslowski J, Strasburger K.
europepmc   +1 more source

Electron densities in active galaxies [PDF]

Nature, 1983
openaire   +2 more sources

FLEXR-MSA: electron-density map comparisons of sequence-diverse structures. [PDF]

IUCrJ
Stachowski TR, Fischer M.
europepmc   +1 more source

LAGNet: better electron density prediction for LCAO-based data and drug-like substances. [PDF]

J Cheminform
Ushenin K, Khrabrov K, Tsypin A, Ber A, Rumiantsev E, Kadurin A.   +5 more
europepmc   +1 more source