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Wave function
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Keyword
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Wave function
RIS
0.003
(Research Intensity Score)
Papers
510
Top papers
Independent gradient model based on Hirshfeld partition: A new method for visual study of interactions in chemical systems
2022 · 3740 citations
Exploring Nature and Predicting Strength of Hydrogen Bonds: A Correlation Analysis Between Atoms‐in‐Molecules Descriptors, Binding Energies, and Energy Components of Symmetry‐Adapted Perturbation Theory
2019 · 1591 citations
Designing spin and orbital sources of Berry curvature at oxide interfaces
2023 · 68 citations
All‐electron scalar relativistic basis sets for the elements Rb–Xe
2020 · 274 citations
LOBSTER: A tool to extract chemical bonding from plane‐wave based DFT
2016 · 3568 citations
Pair wave function symmetry in UTe 2 from zero-energy surface state visualization
2025 · 14 citations
Understanding discrepancies in noncovalent interaction energies from wavefunction theories for large molecules
2025 · 9 citations
The confined helium atom: An information–theoretic approach
2024 · 27 citations
Fully Analytic Nuclear Gradients for the Bethe–Salpeter Equation
2025 · 8 citations
Newest papers
Confinement-Induced Quantum Vacuum Asymmetry as a Testable Source of Effective Negative Mass
2026 · 2 citations
Excitonic landscape and quasi-type-I nature in Moiré supercells of Ti-based MXene-MoS2 van der Waals heterostructures
2026
Using energy decomposition analysis from correlated wavefunction theory to characterize a range of hydrogen, halogen, and tetrel bonds: The relative importance of electrostatics, charge-transfer and polarization.
2026
Atomically resolved wavefunction of integer and fractional quantum anomalous Hall states in twisted bilayer graphene
2026
Transfer Learning Meets Embedded Correlated Wavefunction Theory for Chemically Accurate Molecular Simulations: Application to Calcium Carbonate Ion Pairing
2026 · 1 citations
Core/ShellHgCdTe/HgCdSe Quantum Dots for Wave FunctionEngineering with Infrared Band Gaps
2026
Tunable g-Factors of Hybridized Orbitals in a Quantum Dot Molecule
2026
Statistics of Marginal Wave Functions as a Real-SpaceDiagnostic of Quantum Entanglement
2026
Effective single particle picture for anharmonic lattice dynamics: a Rosetta stone for electronic and ionic response
2026
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