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Calculation of the electric field gradient tensor from energy band structures

https://doi.org/10.1007/bf02407802
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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/qua.560230435openalex-snapshot
Electron densities and chemical bonding in TiC, TiN, and TiO derived from energy band calculations
inferredcites →https://doi.org/10.1007/978-3-642-46571-0openalex-snapshot
Microscopic Methods in Metals
inferredcites →https://doi.org/10.1007/bf00309465openalex-snapshot
The electric field gradient at the position of copper in Cu2O and electronic charge density analysis by means of K-factors
inferredcites →https://doi.org/10.1007/bf02072723openalex-snapshot
Hartree-Fock cluster investigations of electronic structure and nuclear quadrupole interaction in the superionic conductor Li3N
inferredcites →https://doi.org/10.1007/bf02159737openalex-snapshot
Systematics of electric field gradients in metals
inferredcites →https://doi.org/10.1016/0022-3697(85)90164-7openalex-snapshot
Nuclear quadrupole interaction and chemical bonding. MSXα cluster calculation for Cu2O
inferredcites →https://doi.org/10.1016/0038-1098(78)90354-xopenalex-snapshot
Itinerant ferromagnetism in fcc cobalt
inferredcites →https://doi.org/10.1063/1.524800openalex-snapshot
Solution of Poisson’s equation: Beyond Ewald-type methods
inferredcites →https://doi.org/10.1088/0022-3719/13/5/004openalex-snapshot
NMR spectra of Li and N in single crystals of Li3N: discussion of ionic nature
inferredcites →https://doi.org/10.1103/physrev.104.1364openalex-snapshot
Dependence of the Pure Quadrupole Resonance Frequency on Pressure and Temperature
inferredcites →https://doi.org/10.1103/physrevb.37.2792openalex-snapshot
First-principles calculation of the electric-field gradient in hcp metals
inferredcites →https://doi.org/10.1103/physrevlett.54.1192openalex-snapshot
First-Principles Calculation of the Electric Field Gradient of Li3 N
inferredcites →https://doi.org/10.1515/zna-1986-1-209openalex-snapshot
Current Status of Theory of Nuclear Quadrupole Interaction in Metallic Systems
inferredcites →https://doi.org/10.1524/zpch.1991.173.part_1.125openalex-snapshot
Topics in Current Physics

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.4841531openalex-extracted
A Combined Solid-State 1h, 13c, 17o Nmr and Periodic Dft Study of Hyperfine Coupling Tensors in Paramagnetic Copper(Ii) Compounds
inferred← citeshttps://doi.org/10.1002/mrc.2646openalex-snapshot
Prediction of NMR J-coupling in solids with the planewave pseudopotential approach
inferred← citeshttps://doi.org/10.1007/978-3-642-84345-7_64openalex-snapshot
Charge Distribution and Electric Field Gradient Calculations for YBa2Cu3O7−x
inferred← citeshttps://doi.org/10.1016/0010-4655(90)90187-6openalex-snapshot
Full-potential, linearized augmented plane wave programs for crystalline systems
inferred← citeshttps://doi.org/10.1016/0304-8853(92)90962-nopenalex-snapshot
Pressure dependence of the NQR of YbInCu4
inferred← citeshttps://doi.org/10.1016/j.jnoncrysol.2005.01.069openalex-snapshot
Electric field gradient in transition metal amorphous alloys
inferred← citeshttps://doi.org/10.1016/j.ssnmr.2024.101945openalex-snapshot
A combined solid-state 1H, 13C, 17O NMR and periodic DFT study of hyperfine coupling tensors in paramagnetic copper(II) compounds
inferred← citeshttps://doi.org/10.1021/cr300108aopenalex-snapshot
First-Principles Calculation of NMR Parameters Using the Gauge Including Projector Augmented Wave Method: A Chemist’s Point of View
inferred← citeshttps://doi.org/10.1021/jp1036525openalex-snapshot
45Sc Spectroscopy of Solids: Interpretation of Quadrupole Interaction Parameters and Chemical Shifts
inferred← citeshttps://doi.org/10.1039/9781837673179-00061openalex-snapshot
First-principles Calculation of NMR Parameters
inferred← citeshttps://doi.org/10.1039/d4fd00128aopenalex-snapshot
High-throughput calculations and machine learning modeling of 17 O NMR in non-magnetic oxides
inferred← citeshttps://doi.org/10.1063/1.361795openalex-snapshot
Mössbauer effect study of face-centered-cubic-like Fe on Cu(001)
inferred← citeshttps://doi.org/10.1088/0953-8984/3/1/011openalex-snapshot
Pressure dependence of the electric field gradient at the63Cu nucleus of Cu2O and CuO; implications for the analysis of NQR measurements on high Tcsuperconductors
inferred← citeshttps://doi.org/10.1103/physrevb.42.2051openalex-snapshot
Charge distribution and electric-field gradients in YBa2 Cu3 O7−x
inferred← citeshttps://doi.org/10.1103/physrevb.52.3909openalex-snapshot
Electric-field-gradient calculations on cadmium in cadmium-helium vacancy clusters in tungsten
inferred← citeshttps://doi.org/10.1103/physrevb.55.14200openalex-snapshot
Perturbed-angular-correlation study of the electric-field gradient in doped181 and implanted indium sesquioxide
inferred← citeshttps://doi.org/10.1103/physrevb.62.11359openalex-snapshot
Magnetic relaxation properties of helium-3 adsorbed on hexagonal boron nitride
inferred← citeshttps://doi.org/10.1103/physrevlett.74.3053openalex-snapshot
Mössbauer Effect Study of Magnetism and Structure of fcc-like Fe(001) Films on Cu(001)
inferred← citeshttps://doi.org/10.1149/1.1544634openalex-snapshot
A Theoretical and Experimental Study of the Lithiation of η[sup ʹ]-Cu[sub 6]Sn[sub 5] in a Lithium-Ion Battery
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