Properties (56)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
mathematical function
|
| gptkbp:appliesTo |
atomic orbitals
|
| gptkbp:description |
electron distribution
|
| gptkbp:hasStaff |
spherical
|
| https://www.w3.org/2000/01/rdf-schema#label |
Slater-type orbital
|
| gptkbp:isAvenueFor |
computational chemistry
|
| gptkbp:isCharacterizedBy |
angular momentum
principal quantum number exponential decay symmetry properties orbital angular momentum |
| gptkbp:isCitedBy |
Schrödinger equation
quantum numbers exponential functions normalization conditions radial functions |
| gptkbp:isConsidered |
density functional theory
|
| gptkbp:isImportantFor |
chemical bonding
reaction mechanisms |
| gptkbp:isInfluencedBy |
electron shielding
nuclear charge external fields |
| gptkbp:isLocatedIn |
polar coordinates
linear combination Cartesian coordinates linear combinations of atomic orbitals atomic units product of functions |
| gptkbp:isPartOf |
wave function
atomic theory quantum_field_theory chemical_systems quantum_mechanical_models |
| gptkbp:isRelatedTo |
molecular interactions
electron correlation electron density spin states orbital hybridization Pauli_exclusion_principle |
| gptkbp:isSimilarTo |
Gaussian-type orbital
|
| gptkbp:isUsedBy |
multi-electron systems
|
| gptkbp:isUsedFor |
energy levels
molecular geometry calculating energies other orbitals |
| gptkbp:isUsedIn |
spectroscopy
ab initio calculations quantum_simulations Hartree-Fock_method |
| gptkbp:isUtilizedIn |
gptkb:quantum_computing
theoretical chemistry molecular orbital theory quantum_mechanics |
| gptkbp:mayHave |
hydrogen-like atoms
|
| gptkbp:namedAfter |
gptkb:John_C._Slater
|
| gptkbp:usedIn |
quantum_chemistry
|