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The Dalton quantum chemistry program systemAssignment of the Q-bands of the chlorophylls: coherence loss via Qx - Qy mixing.Studies of the ground and excited-state surfaces of the retinal chromophore using CAM-B3LYP.A correlated ab initio quantum chemical study of the interaction of the Na+, Mg2+, Ca2+ and Zn2+ ions with the tautomers of cytosine in the presence of polar solvent.Formation of water-chlorophyll clusters in dilute samples of chlorophyll-a in ether at low temperature.Microsolvation within the Systematic Molecular Fragmentation by Annihilation Approach.Understanding and Calibrating Density-Functional-Theory Calculations Describing the Energy and Spectroscopy of Defect Sites in Hexagonal Boron Nitride.A new fundamental type of conformational isomerismAssessment of the efficiency of long-range corrected functionals for some properties of large compoundsFirst hyperpolarizability of polymethineimine with long-range corrected functionalsApplication of the Systematic Molecular Fragmentation by Annihilation Method to Ab Initio NMR Chemical Shift CalculationsComparison of coupled-cluster and Brueckner coupled-cluster calculations of molecular propertiesComparison of the Brueckner and coupled‐cluster approaches to electron correlationA direct atomic orbital driven implementation of the coupled cluster singles and doubles (CCSD) modelMulticonfigurational self‐consistent field calculations of nuclear shieldings using London atomic orbitalsPublisher Correction: A new fundamental type of conformational isomerismDensity Functional Theory for Charge Transfer: The Nature of the N-Bands of Porphyrins and Chlorophylls Revealed through CAM-B3LYP, CASPT2, and SAC-CI CalculationsCorrelated ab initio quantum chemical study of the interaction of the Na+, Mg2+, Ca2+, and Zn2+ ions with the tautomers of cytosineTheoretical studies on the stability of molecular platinum catalysts for hydrogen productionSystematic Study of Locally Dense Basis Sets for NMR Shielding ConstantsAb Initio NMR Chemical Shift Calculations Using Fragment Molecular Orbitals and Locally Dense Basis SetsFeature Engineering for Materials Chemistry-Does Size Matter?Solvent-Specific Featurization for Predicting Free Energies of Solvation through Machine LearningNWChem: Past, present, and future
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description
researcher ORCID ID = 0000-0002-0672-833X
@en
wetenschapper
@nl
name
Rika Kobayashi
@ast
Rika Kobayashi
@en
Rika Kobayashi
@es
Rika Kobayashi
@nl
type
label
Rika Kobayashi
@ast
Rika Kobayashi
@en
Rika Kobayashi
@es
Rika Kobayashi
@nl
prefLabel
Rika Kobayashi
@ast
Rika Kobayashi
@en
Rika Kobayashi
@es
Rika Kobayashi
@nl
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P1153
23015136800
P31
P496
0000-0002-0672-833X