Amanote Research
Register
Sign In
Discover open access scientific publications
Search, annotate, share and cite publications
Publications by Peter Hrobarik
Four-Component Relativistic Density Functional Theory With the Polarisable Continuum Model: Application to EPR Parameters and Paramagnetic NMR Shifts
Molecular Physics
Theoretical Chemistry
Biophysics
Condensed Matter Physics
Molecular Biology
Physical
Related publications
Prediction of 89Y NMR Chemical Shifts in Organometallic Complexes With Density Functional Theory
Density Functional Theory Study of the Oxoperoxo Vanadium(V) Complexes of Glycolic Acid. Structural Correlations With NMR Chemical Shifts
Dalton Transactions
Inorganic Chemistry
Refining Crystal Structures With Quadrupolar NMR and Dispersion-Corrected Density Functional Theory
One-Dimensional Continuum Electronic Structure With the Density-Matrix Renormalization Group and Its Implications for Density-Functional Theory
Physical Review Letters
Astronomy
Physics
Nuclear Magnetic Resonance Chemical Shifts With the Statistical Average of Orbital-Dependent Model Potentials in Kohn–Sham Density Functional Theory
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Multicomponent Density Functional Theory With Density Fitting
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Introduction to Relativistic Continuum Mechanics
Relativistic Density Functional for Nuclear Matter
EPJ Web of Conferences
Astronomy
Physics
Four-Component Relativistic 31P NMR Calculations for Trans-Platinum(ii) Complexes: Importance of the Solvent and Dynamics in Spectral Simulations
Dalton Transactions
Inorganic Chemistry
