VIAF

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Leader     00000nz a2200037n 45 0
001     WKP|Q57072430  (VIAF cluster)  (Authority/Source Record)
003     WKP
005     20241121000232.0
008     241121nneanz||abbn n and d
035 ‎‡a  (WKP)Q57072430‏
024 ‎‡a  0000-0001-8938-1927‏ ‎‡2  orcid‏
024 ‎‡a  0000-0001-7959-3213‏ ‎‡2  orcid‏
035 ‎‡a  (OCoLC)Q57072430‏
100 0 ‎‡a  Yu Zhang‏ ‎‡c  researcher ORCID: 0000-0001-8938-1927‏ ‎‡9  en‏
670 ‎‡a  Author's A multiscale quantum mechanics/electromagnetics method for device simulations‏
670 ‎‡a  Author's A variational approach for dissipative quantum transport in a wide parameter space‏
670 ‎‡a  Author's Advantages of Conical Pores for Ion Pumps‏
670 ‎‡a  Author's An Ab Initio Multiple Cloning Method for Non-Adiabatic Excited-State Molecular Dynamics in NWChem‏
670 ‎‡a  Author's An approximate framework for quantum transport calculation with model order reduction‏
670 ‎‡a  Author's Comprehensive Experimental and Computational Spectroscopic Study of Hexacyanoferrate Complexes in Water: From Infrared to X-ray Wavelengths‏
670 ‎‡a  Author's Conical Nanopores for Efficient Ion Pumping and Desalination‏
670 ‎‡a  Author's Dissipative time-dependent quantum transport theory‏
670 ‎‡a  Author's Dissipative time-dependent quantum transport theory: Quantum interference and phonon induced decoherence dynamics‏
670 ‎‡a  Author's Double core hole valence-to-core x-ray emission spectroscopy: A theoretical exploration using time-dependent density functional theory‏
670 ‎‡a  Author's First-principles time-dependent quantum transport theory‏
670 ‎‡a  Author's Fundamental Limitations to Plasmonic Hot-Carrier Solar Cells‏
670 ‎‡a  Author's Identifying Cu‏
670 ‎‡a  Author's Identifying Cu(ii)-amyloid peptide binding intermediates in the early stages of aggregation by resonance Raman spectroscopy: a simulation study.‏
670 ‎‡a  Author's Interference and Molecular Transport-A Dynamical View: Time-Dependent Analysis of Disubstituted Benzenes‏
670 ‎‡a  Author's Interlayer-Decoupled Sc-Based Mxene with High Carrier Mobility and Strong Light-Harvesting Ability‏
670 ‎‡a  Author's Kinetic Master Equation Modeling of an Artificial Protein Pump‏
670 ‎‡a  Author's Light-Driven Ca‏
670 ‎‡a  Author's Light-Driven Ca(2+) Ion Pump: How Does It Work?‏
670 ‎‡a  Author's Mixed-Valence Superstructure Assembled from a Mixed-Valence Host–Guest Complex‏
670 ‎‡a  Author's Monitoring Ultrafast Spin Crossover Intermediates in an Iron‏
670 ‎‡a  Author's Monitoring Ultrafast Spin Crossover Intermediates in an Iron(II) Complex by Broad Band Stimulated X-ray Raman Spectroscopy‏
670 ‎‡a  Author's Multiscale Modeling of Plasmon-Enhanced Power Conversion Efficiency in Nanostructured Solar Cells.‏
670 ‎‡a  Author's Multiscale Study of Plasmonic Scattering and Light Trapping Effect in Silicon Nanowire Array Solar Cells.‏
670 ‎‡a  Author's Non-adiabatic Excited-State Molecular Dynamics: Theory and Applications for Modeling Photophysics in Extended Molecular Materials‏
670 ‎‡a  Author's Non-adiabatic molecular dynamics of molecules in the presence of strong light-matter interactions‏
670 ‎‡a  Author's Nonadiabatic Excited-State Molecular Dynamics for Open-Shell Systems‏
670 ‎‡a  Author's Plasmonic Hot-Carrier-Mediated Tunable Photochemical Reactions‏
670 ‎‡a  Author's Quantum mechanical modeling the emission pattern and polarization of nanoscale light emitting diodes‏
670 ‎‡a  Author's Quantum-Mechanical Prediction of Nanoscale Photovoltaics‏
670 ‎‡a  Author's Quantum Simulation of Molecular Electronic States with a Transcorrelated Hamiltonian: Higher Accuracy with Fewer Qubits‏
670 ‎‡a  Author's Quantum transport through an array of quantum dots‏
670 ‎‡a  Author's Site-Specific Photodecomposition in Conjugated Energetic Materials‏
670 ‎‡a  Author's Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package‏
670 ‎‡a  Author's Stark control of electrons along nanojunctions.‏
670 ‎‡a  Author's Stimulated X-Ray Emission Spectroscopy in Transition Metal Complexes.‏
670 ‎‡a  Author's Supramolecular Double-Helix Formation by Diastereoisomeric Conformations of Configurationally Enantiomeric Macrocycles.‏
670 ‎‡a  Author's Supramolecular Gelation of Rigid Triangular Macrocycles through Rings of Multiple C-H···O Interactions Acting Cooperatively‏
670 ‎‡a  Author's Time-dependent density functional theory for quantum transport‏
670 ‎‡a  Author's Time-dependent quantum transport theory and its applications to graphene nanoribbons‏
670 ‎‡a  Author's Toward a QUBO-Based Density Matrix Electronic Structure Method‏
670 ‎‡a  Author's X-ray circular dichroism signals: a unique probe of local molecular chirality.‏
670 ‎‡a  Author's X-ray Raman optical activity of chiral molecules‏
670 ‎‡a  Author's ఒక కృత్రిమ ప్రోటీన్ పంప్ యొక్క కైనెటిక్ మాస్టర్ ఈక్వేషన్ మోడలింగ్‏
909 ‎‡a  (orcid) 0000000179593213‏ ‎‡9  1‏
909 ‎‡a  (orcid) 0000000189381927‏ ‎‡9  1‏
919 ‎‡a  comprehensiveexperimentalandcomputationalspectroscopicstudyofhexacyanoferratecomplexesinwaterfrominfraredto10raywavelengths‏ ‎‡A  Comprehensive Experimental and Computational Spectroscopic Study of Hexacyanoferrate Complexes in Water: From Infrared to X-ray Wavelengths‏ ‎‡9  1‏
919 ‎‡a  approximateframeworkforquantumtransportcalculationwithmodelorderreduction‏ ‎‡A  An approximate framework for quantum transport calculation with model order reduction‏ ‎‡9  1‏
919 ‎‡a  abinitiomultiplecloningmethodfornonadiabaticexcitedstatemoleculardynamicsinnwchem‏ ‎‡A  An Ab Initio Multiple Cloning Method for Non-Adiabatic Excited-State Molecular Dynamics in NWChem‏ ‎‡9  1‏
919 ‎‡a  advantagesofconicalporesforionpumps‏ ‎‡A  Advantages of Conical Pores for Ion Pumps‏ ‎‡9  1‏
919 ‎‡a  variationalapproachfordissipativequantumtransportinawideparameterspace‏ ‎‡A  A variational approach for dissipative quantum transport in a wide parameter space‏ ‎‡9  1‏
919 ‎‡a  multiscalequantummechanicselectromagneticsmethodfordevicesimulations‏ ‎‡A  A multiscale quantum mechanics/electromagnetics method for device simulations‏ ‎‡9  1‏
919 ‎‡a  doublecoreholevalencetocore10rayemissionspectroscopyatheoreticalexplorationusingtimedependentdensityfunctionaltheory‏ ‎‡A  Double core hole valence-to-core x-ray emission spectroscopy: A theoretical exploration using time-dependent density functional theory‏ ‎‡9  1‏
919 ‎‡a  1principlestimedependentquantumtransporttheory‏ ‎‡A  First-principles time-dependent quantum transport theory‏ ‎‡9  1‏
919 ‎‡a  fundamentallimitationstoplasmonichotcarriersolarcells‏ ‎‡A  Fundamental Limitations to Plasmonic Hot-Carrier Solar Cells‏ ‎‡9  1‏
919 ‎‡a  identifyingcu‏ ‎‡A  Identifying Cu‏ ‎‡9  1‏
919 ‎‡a  identifyingcu2amyloidpeptidebindingintermediatesintheearlystagesofaggregationbyresonanceramanspectroscopyasimulationstudy‏ ‎‡A  Identifying Cu(ii)-amyloid peptide binding intermediates in the early stages of aggregation by resonance Raman spectroscopy: a simulation study.‏ ‎‡9  1‏
919 ‎‡a  interferenceandmoleculartransportadynamicalviewtimedependentanalysisofdisubstitutedbenzenes‏ ‎‡A  Interference and Molecular Transport-A Dynamical View: Time-Dependent Analysis of Disubstituted Benzenes‏ ‎‡9  1‏
919 ‎‡a  interlayerdecoupledscbasedmxenewithhighcarriermobilityandstronglightharvestingability‏ ‎‡A  Interlayer-Decoupled Sc-Based Mxene with High Carrier Mobility and Strong Light-Harvesting Ability‏ ‎‡9  1‏
919 ‎‡a  kineticmasterequationmodelingofanartificialproteinpump‏ ‎‡A  Kinetic Master Equation Modeling of an Artificial Protein Pump‏ ‎‡9  1‏
919 ‎‡a  lightdrivenca‏ ‎‡A  Light-Driven Ca‏ ‎‡9  1‏
919 ‎‡a  lightdrivenca2+ionpumphowdoesitwork‏ ‎‡A  Light-Driven Ca(2+) Ion Pump: How Does It Work?‏ ‎‡9  1‏
919 ‎‡a  mixedvalencesuperstructureassembledfromamixedvalencehostguestcomplex‏ ‎‡A  Mixed-Valence Superstructure Assembled from a Mixed-Valence Host–Guest Complex‏ ‎‡9  1‏
919 ‎‡a  monitoringultrafastspincrossoverintermediatesinaniron‏ ‎‡A  Monitoring Ultrafast Spin Crossover Intermediates in an Iron‏ ‎‡9  1‏
919 ‎‡a  monitoringultrafastspincrossoverintermediatesinaniron2complexbybroadbandstimulated10rayramanspectroscopy‏ ‎‡A  Monitoring Ultrafast Spin Crossover Intermediates in an Iron(II) Complex by Broad Band Stimulated X-ray Raman Spectroscopy‏ ‎‡9  1‏
919 ‎‡a  multiscalemodelingofplasmonenhancedpowerconversionefficiencyinnanostructuredsolarcells‏ ‎‡A  Multiscale Modeling of Plasmon-Enhanced Power Conversion Efficiency in Nanostructured Solar Cells.‏ ‎‡9  1‏
919 ‎‡a  multiscalestudyofplasmonicscatteringandlighttrappingeffectinsiliconnanowirearraysolarcells‏ ‎‡A  Multiscale Study of Plasmonic Scattering and Light Trapping Effect in Silicon Nanowire Array Solar Cells.‏ ‎‡9  1‏
919 ‎‡a  nonadiabaticexcitedstatemoleculardynamicstheoryandapplicationsformodelingphotophysicsinextendedmolecularmaterials‏ ‎‡A  Non-adiabatic Excited-State Molecular Dynamics: Theory and Applications for Modeling Photophysics in Extended Molecular Materials‏ ‎‡9  1‏
919 ‎‡a  nonadiabaticmoleculardynamicsofmoleculesinthepresenceofstronglightmatterinteractions‏ ‎‡A  Non-adiabatic molecular dynamics of molecules in the presence of strong light-matter interactions‏ ‎‡9  1‏
919 ‎‡a  nonadiabaticexcitedstatemoleculardynamicsforopenshellsystems‏ ‎‡A  Nonadiabatic Excited-State Molecular Dynamics for Open-Shell Systems‏ ‎‡9  1‏
919 ‎‡a  plasmonichotcarriermediatedtunablephotochemicalreactions‏ ‎‡A  Plasmonic Hot-Carrier-Mediated Tunable Photochemical Reactions‏ ‎‡9  1‏
919 ‎‡a  quantummechanicalmodelingtheemissionpatternandpolarizationofnanoscalelightemittingdiodes‏ ‎‡A  Quantum mechanical modeling the emission pattern and polarization of nanoscale light emitting diodes‏ ‎‡9  1‏
919 ‎‡a  quantummechanicalpredictionofnanoscalephotovoltaics‏ ‎‡A  Quantum-Mechanical Prediction of Nanoscale Photovoltaics‏ ‎‡9  1‏
919 ‎‡a  quantumsimulationofmolecularelectronicstateswithatranscorrelatedhamiltonianhigheraccuracywithfewerqubits‏ ‎‡A  Quantum Simulation of Molecular Electronic States with a Transcorrelated Hamiltonian: Higher Accuracy with Fewer Qubits‏ ‎‡9  1‏
919 ‎‡a  quantumtransportthroughanarrayofquantumdots‏ ‎‡A  Quantum transport through an array of quantum dots‏ ‎‡9  1‏
919 ‎‡a  sitespecificphotodecompositioninconjugatedenergeticmaterials‏ ‎‡A  Site-Specific Photodecomposition in Conjugated Energetic Materials‏ ‎‡9  1‏
919 ‎‡a  softwareforthefrontiersofquantumchemistryanoverviewofdevelopmentsintheqchem5package‏ ‎‡A  Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package‏ ‎‡9  1‏
919 ‎‡a  starkcontrolofelectronsalongnanojunctions‏ ‎‡A  Stark control of electrons along nanojunctions.‏ ‎‡9  1‏
919 ‎‡a  stimulated10rayemissionspectroscopyintransitionmetalcomplexes‏ ‎‡A  Stimulated X-Ray Emission Spectroscopy in Transition Metal Complexes.‏ ‎‡9  1‏
919 ‎‡a  supramoleculardoublehelixformationbydiastereoisomericconformationsofconfigurationallyenantiomericmacrocycles‏ ‎‡A  Supramolecular Double-Helix Formation by Diastereoisomeric Conformations of Configurationally Enantiomeric Macrocycles.‏ ‎‡9  1‏
919 ‎‡a  supramoleculargelationofrigidtriangularmacrocyclesthroughringsofmultiple100hointeractionsactingcooperatively‏ ‎‡A  Supramolecular Gelation of Rigid Triangular Macrocycles through Rings of Multiple C-H···O Interactions Acting Cooperatively‏ ‎‡9  1‏
919 ‎‡a  timedependentdensityfunctionaltheoryforquantumtransport‏ ‎‡A  Time-dependent density functional theory for quantum transport‏ ‎‡9  1‏
919 ‎‡a  timedependentquantumtransporttheoryanditsapplicationstographenenanoribbons‏ ‎‡A  Time-dependent quantum transport theory and its applications to graphene nanoribbons‏ ‎‡9  1‏
919 ‎‡a  towardaqubobaseddensitymatrixelectronicstructuremethod‏ ‎‡A  Toward a QUBO-Based Density Matrix Electronic Structure Method‏ ‎‡9  1‏
919 ‎‡a  10raycirculardichroismsignalsauniqueprobeoflocalmolecularchirality‏ ‎‡A  X-ray circular dichroism signals: a unique probe of local molecular chirality.‏ ‎‡9  1‏
919 ‎‡a  10rayramanopticalactivityofchiralmolecules‏ ‎‡A  X-ray Raman optical activity of chiral molecules‏ ‎‡9  1‏
919 ‎‡a  ఒకకతరమపరటనపపయకకకనటకమసటరఈకవషనమడలగ‏ ‎‡A  ఒక కృత్రిమ ప్రోటీన్ పంప్ యొక్క కైనెటిక్ మాస్టర్ ఈక్వేషన్ మోడలింగ్‏ ‎‡9  1‏
919 ‎‡a  dissipativetimedependentquantumtransporttheoryquantuminterferenceandphononinduceddecoherencedynamics‏ ‎‡A  Dissipative time-dependent quantum transport theory: Quantum interference and phonon induced decoherence dynamics‏ ‎‡9  1‏
919 ‎‡a  dissipativetimedependentquantumtransporttheory‏ ‎‡A  Dissipative time-dependent quantum transport theory‏ ‎‡9  1‏
919 ‎‡a  conicalnanoporesforefficientionpumpinganddesalination‏ ‎‡A  Conical Nanopores for Efficient Ion Pumping and Desalination‏ ‎‡9  1‏
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996 ‎‡2  DNB|133095386X
996 ‎‡2  DNB|1268557897
996 ‎‡2  LC|n 2024007042
996 ‎‡2  CYT|AC000399385
996 ‎‡2  SUDOC|264808045
996 ‎‡2  DNB|1137538821
996 ‎‡2  DNB|173988539
996 ‎‡2  CAOONL|ncf11618054
996 ‎‡2  CYT|AC000646768
996 ‎‡2  CYT|AC000640108
997 ‎‡a  0 0 lived 0 0‏ ‎‡9  1‏