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Hybrid density functional theory calculations for the electronic and optical properties of Fe 3+ -doped KDP crystals
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1002/crat.201600075openalex-snapshot
KDP single crystal growth via three‐dimensional motion growth method
inferredcites →https://doi.org/10.1007/b138685openalex-snapshot
Nonlinear Optical Crystals: A Complete Survey
inferredcites →https://doi.org/10.1016/0927-0256(96)00008-0openalex-snapshot
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
inferredcites →https://doi.org/10.1016/j.actamat.2007.04.005openalex-snapshot
Prediction of high-temperature point defect formation in TiO2 from combined ab initio and thermodynamic calculations
inferredcites →https://doi.org/10.1016/j.commatsci.2020.109783openalex-snapshot
Comparison of oxygen vacancy and interstitial oxygen in KDP and ADP crystals from density functional theory calculations
inferredcites →https://doi.org/10.1016/s0022-0248(01)00911-3openalex-snapshot
Optical absorption and electron paramagnetic resonance of Fe ions in KDP crystals
inferredcites →https://doi.org/10.1039/c8cp07685eopenalex-snapshot
Comparison of hydrogen vacancies in KDP and ADP crystals: a combination of density functional theory calculations and experiment
inferredcites →https://doi.org/10.1039/c9ce01937eopenalex-snapshot
Structural stress and extra optical absorption induced by the intrinsic cation defects in KDP and ADP crystals: a theoretical study
inferredcites →https://doi.org/10.1039/d1ce01140eopenalex-snapshot
Hybrid density functional theory for the stability and electronic properties of Fe-doped cluster defects in KDP crystal
inferredcites →https://doi.org/10.1063/1.2085170openalex-snapshot
Energy band gaps and lattice parameters evaluated with the Heyd-Scuseria-Ernzerhof screened hybrid functional
inferredcites →https://doi.org/10.1063/1.2204597openalex-snapshot
Erratum: “Hybrid functionals based on a screened Coulomb potential” [J. Chem. Phys. 118, 8207 (2003)]
inferredcites →https://doi.org/10.1063/1.2404663openalex-snapshot
Influence of the exchange screening parameter on the performance of screened hybrid functionals
inferredcites →https://doi.org/10.1063/1.478401openalex-snapshot
Assessment of the Perdew–Burke–Ernzerhof exchange-correlation functional
inferredcites →https://doi.org/10.1098/rspa.1953.0195openalex-snapshot
A neutron diffraction study of potassium dihydrogen phosphate by Fourier synthesis
inferredcites →https://doi.org/10.1103/physrev.140.a1133openalex-snapshot
Self-Consistent Equations Including Exchange and Correlation Effects
inferredcites →https://doi.org/10.1103/physrev.70.529openalex-snapshot
Elastic, Piezoelectric, and Dielectric Properties of Sodium Chlorate and Sodium Bromate
inferredcites →https://doi.org/10.1103/physreva.38.3098openalex-snapshot
Density-functional exchange-energy approximation with correct asymptotic behavior
inferredcites →https://doi.org/10.1103/physrevb.50.17953openalex-snapshot
Projector augmented-wave method
inferredcites →https://doi.org/10.1103/physrevb.53.1749openalex-snapshot
Nanosecond-to-femtosecond laser-induced breakdown in dielectrics
inferredcites →https://doi.org/10.1103/physrevb.54.11169openalex-snapshot
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
inferredcites →https://doi.org/10.1103/physrevb.59.1758openalex-snapshot
From ultrasoft pseudopotentials to the projector augmented-wave method
inferredcites →https://doi.org/10.1103/physrevb.68.224107openalex-snapshot
Electronic structure calculations of intrinsic and extrinsic hydrogen point defects in KH2PO4
inferredcites →https://doi.org/10.1103/physrevb.72.134110openalex-snapshot
Electronic structure calculations of an oxygen vacancy in KH2PO4
inferredcites →https://doi.org/10.1103/physrevlett.55.1014openalex-snapshot
Spin-Glass State of a Randomly Diluted Granular Superconductor
inferredcites →https://doi.org/10.1103/physrevlett.66.1438openalex-snapshot
Direct calculation of electron density in density-functional theory
inferredcites →https://doi.org/10.1103/physrevlett.91.015505openalex-snapshot
Electron- or Hole-Assisted Reactions of H Defects in Hydrogen-Bonded KDP
inferredcites →https://doi.org/10.1103/physrevlett.92.087401openalex-snapshot
Localized Dynamics during Laser-Induced Damage in Optical Materials
inferredcites →https://doi.org/10.1107/s0365110x53000776openalex-snapshot
X-ray analysis of the ferroelectric transition in KH2PO4
inferredcites →https://doi.org/10.1143/jpsj.40.204openalex-snapshot
ESR Study of Fe3+ Ions Doped in KDP Crystal
inferredcites →https://doi.org/10.1179/095066001225001085openalex-snapshot
Developing KH 2 PO 4 and KD 2 PO 4 crystals for the world's most power laser
inferredcites →https://doi.org/10.1364/ao.54.004167openalex-snapshot
Evaluating the safe limit of large-aperture potassium dihydrogen phosphate crystals associated with transverse stimulated Raman scattering
inferredcites →https://doi.org/10.1364/josab.11.000774openalex-snapshot
Ultraviolet-induced transient absorption in potassium dihydrogen phosphate and its influence on frequency conversion
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.2139/ssrn.4669321openalex-extracted
Compensation Mechanisms, Optical Properties, and Electronic Structures for the Ba Impurities in Kh2po4 Crystals
inferred← citeshttps://doi.org/10.1002/jcc.70065openalex-snapshot
Mechanistic Study of LIDT Reduction in KH2PO4 With Yi Predicted by Density Functional Theory
inferred← citeshttps://doi.org/10.1002/pssb.202500304openalex-snapshot
Study on the Fe P Defects in KH 2 PO 4 Crystals
inferred← citeshttps://doi.org/10.1016/j.commatsci.2025.114252openalex-snapshot
DFT + U study on the hole by FeP in KH2PO4 crystal
inferred← citeshttps://doi.org/10.1016/j.mssp.2025.110196openalex-snapshot
Mechanistic investigation of cluster defect ZnK+VH on laser-induced damage threshold in KH2PO4 crystals
inferred← citeshttps://doi.org/10.1016/j.mtcomm.2024.108788openalex-snapshot
Effect of metal doping on the laser induced damage of KDP crystals: A first-principles study
inferred← citeshttps://doi.org/10.1016/j.mtcomm.2024.109141openalex-snapshot
Optical properties of Ba-impurity defect clusters in KH2PO4 crystals
inferred← citeshttps://doi.org/10.1016/j.mtcomm.2024.109758openalex-snapshot
Insight into the damage mechanism of KH2PO4 crystals with BaK-SiP by hybrid density functional theory
inferred← citeshttps://doi.org/10.1016/j.optlastec.2024.111945openalex-snapshot
Degradation mechanisms of optical properties of KDP crystals induced by nanosecond laser
inferred← citeshttps://doi.org/10.1039/d2ce01469fopenalex-snapshot
Study on the defects of KDP crystal with different states by the positron spectroscopy method
inferred← citeshttps://doi.org/10.1039/d3ce00730hopenalex-snapshot
Study on the optical properties and electronic structures of Ba-doped KH 2 PO 4 crystals
inferred← citeshttps://doi.org/10.1039/d4ma00036fopenalex-snapshot
Influence of Cr 3+ cluster defects on crystal structure and optical properties of KDP crystals studied by DFT and UV-Vis
inferred← citeshttps://doi.org/10.1039/d5ce01097gopenalex-snapshot
Research progress on defect theory of KDP crystals
inferred← citeshttps://doi.org/10.1088/1402-4896/ad75c6openalex-snapshot
Influence of Ca-substituted K-induced cluster defects on the electronic structure and optical properties of KDP crystals
inferred← citeshttps://doi.org/10.1088/1402-4896/ae7c3bopenalex-snapshot
Study on the stability and optical properties of the V H -La K -V H cluster defects in KDP crystal
inferred← citeshttps://doi.org/10.1364/ome.503879openalex-snapshot
Monte Carlo simulation for KDP crystals induced by ultraviolet nanosecond laser irradiation
inferred← citeshttps://doi.org/10.2139/ssrn.4865084openalex-snapshot
Insight into the Damage Mechanism of KH 2PO 4 Crystals with Bak-Sip by Hybrid Density Functional Theory
inferred← citeshttps://doi.org/10.3390/cryst14050410openalex-snapshot
Hybrid Density Functional Theory Calculations for the Crystal Structure and Electronic Properties of Al3+ Doped KDP Crystals
inferred← citeshttps://doi.org/10.7498/aps.75.20260091openalex-snapshot
Density functional theory-guided synergistic optimization of the properties of Group I alkali-metal-doped KH2PO4 crystals
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