Materias dentro de su búsqueda.
Mostrando 1,121 - 1,140 Resultados de 5,592 Para Buscar '"Homo"', tiempo de consulta: 0.15s Limitar resultados
  1. 1121
    “…FTr-3PDI-Se exhibits large conjugated planar conformation, strong absorption spectra in the regions of 300–400 and 450–550 nm, the deep HOMO energy level of 6.10 eV, and high decomposition temperature above 400°C. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Truxene Functionalized Star-Shaped Non-fullerene Acceptor With Selenium-Annulated Perylene Diimides for Efficient Organic Solar Cells
  2. 1122
    por Kumer, Ajoy, Khan, Md. Wahab
    Publicado 2021
    “…Plus, the DFT functional from material studio 8.0 was used for evaluation of computational screening for estimating the chemical reactivity, HOMO, LUMO and HOMO-LUMO gap, recorded from -7.252 to -8.20 kcal/mol. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    The effect of alkyl chain and electronegative atoms in anion on biological activity of anilinium carboxylate bioactive ionic liquids and computational approaches by DFT functional and molecular docking
  3. 1123
    “…We find delays of up to ∼600 as in the ionization out of the highest occupied molecular orbital (HOMO) with a strong dependence on the emission direction and a pronounced asymmetry along the dissociation axis. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Attosecond interferometry of shape resonances in the recoil frame of CF(4)
  4. 1124
    por Fujisawa, Jun-ichi, Hanaya, Minoru
    Publicado 2021
    “…The ionization potential measurement and density functional theory (DFT) analysis reveal that the absorption band is attributed to ICTT from the HOMO of the adsorbed benzoic acid derivatives to the conduction band of SnO(2). …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Interfacial charge-transfer transitions in SnO(2) functionalized with benzoic acid derivatives
  5. 1125
    “…The VIP and VEA reveal that Pd(n)/coronene clusters are stable in nature with the least reactivity. The HOMO–LUMO energy gaps are reduced with the increase in cluster size. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Density functional theory study of palladium cluster adsorption on a graphene support
  6. 1126
    “…Using the DFT/B3LYP/6-31G (d,p) level of theory, HOMO–LUMO energy gap, molecular electrostatic potential (MEP), vibrational (IR) and NMR analyses were carried out. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Synthesis of an unusual quinazoline alkaloid: theoretical and experimental investigations of its structural, electronic, molecular and biological properties
  7. 1127
    “…Calculation of excited-state energy is shown to be essential as the HOMO–lowest unoccupied molecular orbital (LUMO) gap cannot be reliably used to predict the transparency of this material class. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Feasibility of p-Doped Molecular Crystals as Transparent Conductive Electrodes via Virtual Screening
  8. 1128
    por He, Hui-Min, Yang, Hui, Li, Ying, Li, Zhi-Ru
    Publicado 2022
    “…The calculated binding energies, HOMO–LUMO gaps, and VIE values of these compounds reveal that they possess high stability, though the NBO and HOMO analyses show that they are also excess electron compounds. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Theoretical Study of Alkaline-Earth Metal (Be, Mg, and Ca)-Substituted Aluminum Nitride Nanocages With High Stability and Large Nonlinear Optical Responses
  9. 1129
    “…Shorter wavelengths (400–500 nm) give the Glaser homo‐coupling diyne, whereas longer wavelength irradiation (500–940 nm) significantly increases the degree of cross‐coupling Sonogashira coupling products. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Surface‐Plasmon‐Enhanced Transmetalation between Copper and Palladium Nanoparticle Catalyst
  10. 1130
    “…We hypothesize that ontogenetic scaling is the main evolutionary modality in the australopithecines while in the species of Homo it is also necessary to apply transpositions. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Heterochronies and allometries in the evolution of the hominid cranium: a morphometric approach using classical anthropometric variables
  11. 1131
    por Trunk, Richard
    Publicado 1927
    Tabla de Contenidos: “…Froher Tag.--Vol. 2. Ecce homo. Trost. Die Stadt. An die Liebe. Suleika. …”
    Partituras Libro
    Lieder : verschiedene Dichter [Canciones, letra de diferentes poetas]
  12. 1132
    por Famiglietti Secchi, María
    Publicado 2001
    Libro
    Didáctica y metodología de la educación tecnológica : aprender haciendo 3er. ciclo de la E.G.B. y Polimodal /
  13. 1133
    Publicado 2018
    Libro
    Lenguajes artístico-expresivos en diálogo : literatura, cine, teatro y títeres /
  14. 1134
    “…However, deeper tumor shrinkage was obtained in the Homo-HER2-positive group compared with the Hetero-HER2-positive group (p = 0.046). …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Clinical impact of intratumoral HER2 heterogeneity on trastuzumab efficacy in patients with HER2-positive gastric cancer
  15. 1135
    “…Liver RNA‐seq data demonstrated that expression of PPP1R3B, tankyrase (TNKS), Homo sapiens chromosome 8 clone RP11‐10A14.5 (AC022784.1 [LOC157273]), Homo sapiens chromosome 8 clone RP11‐375N15.1 (AC021242.1), and Homo sapiens chromosome 8, clone RP11‐10A14 (AC022784.6) associated with the PPP1R3B genotype. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Protein Phosphatase 1 Regulatory Subunit 3B Genotype at rs4240624 Has a Major Effect on Gallbladder Bile Composition
  16. 1136
    “…It is very important to notice that anti-SARS-CoV main protease of these compounds appear to be mainly governed by five descriptors, i.e. highest occupied molecular orbital energy (E(HOMO)), energy of molecular orbital below HOMO energy (E(HOMO-1)), Balaban index (BI), bond length between the two sulfur atoms (S1S2) and bond length between sulfur atom and benzene ring (S2Bnz). …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    QSAR study of unsymmetrical aromatic disulfides as potent avian SARS-CoV main protease inhibitors using quantum chemical descriptors and statistical methods
  17. 1137
    por McLaren, Peter, 1948-
    Publicado 2003
    Libro
    Pedagogía, identidad y poder : los educadores frente al multiculturalismo /
  18. 1138
    Publicado 2000
    Procedimiento de la Conferencia Libro
    Salud mental : época y subjetividad /
  19. 1139
    “…Through in silico analyses, we found that proteins in the homo class, those that induce LLPS without partner molecules, have different IDRs and LCRs compared with the reference proteome. …”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    Classification of proteins inducing liquid–liquid phase separation: sequential, structural and functional characterization
  20. 1140
    “…Our work indicated that designing a narrow band gap NFSMA-based DTP unit and blending it with a polymer donor with small HOMO offset is an efficient strategy for achieving high performance OSCs.…”
    Enlace del recurso
    Enlace del recurso
    Enlace del recurso
    Online Artículo Texto
    A narrow band gap non-fullerene electron acceptor based on a dithieno-3,2-b:2′,3′-dlpyrrole unit for high performance organic solar cells with minimal highest occupied molecular orbital offset
Herramientas de búsqueda: RSS