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Linear combination of atomic orbitals
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Linear combination of atomic orbitals
RIS
0.000
(Research Intensity Score)
Papers
97
Top papers
QuantumATK: an integrated platform of electronic and atomic-scale modelling tools
2019 · 1934 citations
Experimental and theoretical perspective on band gap modulation in Sr2+ modified BaTiO3 capacitors
2025 · 13 citations
A review on non‐relativistic, fully numerical electronic structure calculations on atoms and diatomic molecules
2019 · 86 citations
Generalization of Intrinsic Orbitals to Kramers-Paired Quaternion Spinors, Molecular Fragments, and Valence Virtual Spinors
2021 · 40 citations
Symmetry of the Hyperfine and Quadrupole Interactions of Boron Vacancies in a Hexagonal Boron Nitride
2023 · 19 citations
Newest papers
Experimental and theoretical perspective on band gap modulation in Sr2+ modified BaTiO3 capacitors
2025 · 13 citations
Orbital contributions to magnetically induced current densities using gauge-including atomic orbitals
2025 · 4 citations
A Comparative Study of A2SiF6 (A = Cs, K) Phosphor Host Matrices: Linear Combination of Atomic Orbital Hybrid Density Functional Theory Calculations
2025 · 3 citations
Density functional theory calculations of the bandstructure of cubic boron arsenide
2025 · 1 citations
Serially improved Gaussian-type orbitals for molecular calculations containing third-row atoms
2025 · 1 citations
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