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机译:
Royal Inst Technol, SE-10691 Stockholm, Sweden;
EXCITED-STATE ABSORPTION; COUPLED-CLUSTER SINGLES; 2-PHOTON ABSORPTION; CROSS-SECTIONS; MULTIBRANCHED STRUCTURES; EXCITATION-ENERGIES; ORGANIC-MOLECULES; CHARGE-TRANSFER; BASIS-SETS; CHROMOPHORES;
机译:MXene-Derived 3D Defect-Rich TiO2@Reduced Graphene Oxide Aerogel with Ultrafast Carrier Separation for Photo-Assisted Uranium Extraction: A Combined Batch, X‑ray Absorption Spectroscopy, and Density Functional Theory Calculations
机译:Characterization of the UV-Visible absorption spectra of manganese(III) porphyrins with time-dependent density functional theory calculations
机译:Calibration of Scalar Relativistic Density Functional Theory for the Calculation of Sulfur K-Edge X-ray Absorption Spectra
机译:Density Functional Calculations on the Distribution, acidity, and Catalysis of TiIV and TiIII Ions in mCm-22 Zeolite