Slater determinant
E645110
A Slater determinant is an antisymmetrized many-electron wavefunction constructed from single-particle orbitals that enforces the Pauli exclusion principle in quantum chemistry and atomic physics.
All labels observed (1)
| Label | Occurrences |
|---|---|
| Slater determinant canonical | 1 |
How this entity was disambiguated
This entity first appeared as the object of triple T7150535 — resolving that mention is where its identity was fixed. The disambiguator weighed these candidate entities and picked the highlighted one (or “None”, minting a new entity). This is how homonymy is resolved: the same surface form can point to different entities.
Target entity: Slater determinant Context triple: [Hartree–Fock method, usesConcept, Slater determinant]
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A.
Hartree–Fock method
The Hartree–Fock method is an approximate quantum mechanical approach for determining the electronic structure of atoms, molecules, and solids by modeling electrons as occupying self-consistent single-particle orbitals.
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B.
Clebsch–Gordan coefficients
Clebsch–Gordan coefficients are numerical factors in quantum mechanics and representation theory that describe how to combine two angular momenta (or group representations) into a single resultant one.
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C.
Bethe–Salpeter equation
The Bethe–Salpeter equation is a relativistic quantum field theory equation that describes bound states of two interacting particles, such as electron–hole pairs in quantum electrodynamics.
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D.
Schmidt decomposition
The Schmidt decomposition is a mathematical technique in functional analysis and quantum information theory that expresses a bipartite vector (such as a quantum state) as a sum of orthogonal product states with nonnegative coefficients, revealing its entanglement structure.
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E.
Born–Huang expansion
The Born–Huang expansion is a quantum mechanical method that systematically improves upon the Born–Oppenheimer approximation by including couplings between electronic and nuclear motions in molecular systems.
- F. None of above. chosen
- G. Unsure - the case is ambiguous/there is not enough information to decide.
Target entity: Slater determinant Target entity description: A Slater determinant is an antisymmetrized many-electron wavefunction constructed from single-particle orbitals that enforces the Pauli exclusion principle in quantum chemistry and atomic physics.
-
A.
Hartree–Fock method
The Hartree–Fock method is an approximate quantum mechanical approach for determining the electronic structure of atoms, molecules, and solids by modeling electrons as occupying self-consistent single-particle orbitals.
-
B.
Clebsch–Gordan coefficients
Clebsch–Gordan coefficients are numerical factors in quantum mechanics and representation theory that describe how to combine two angular momenta (or group representations) into a single resultant one.
-
C.
Bethe–Salpeter equation
The Bethe–Salpeter equation is a relativistic quantum field theory equation that describes bound states of two interacting particles, such as electron–hole pairs in quantum electrodynamics.
-
D.
Schmidt decomposition
The Schmidt decomposition is a mathematical technique in functional analysis and quantum information theory that expresses a bipartite vector (such as a quantum state) as a sum of orthogonal product states with nonnegative coefficients, revealing its entanglement structure.
-
E.
Born–Huang expansion
The Born–Huang expansion is a quantum mechanical method that systematically improves upon the Born–Oppenheimer approximation by including couplings between electronic and nuclear motions in molecular systems.
- F. None of above. chosen
Statements (49)
| Predicate | Object |
|---|---|
| instanceOf |
antisymmetric wavefunction
ⓘ
fermionic wavefunction ⓘ many-electron wavefunction ⓘ mathematical object in quantum mechanics ⓘ tool in atomic physics ⓘ tool in quantum chemistry ⓘ |
| appliesTo |
many-electron atoms
ⓘ
molecules ⓘ solids in independent-electron approximations ⓘ systems of identical fermions ⓘ |
| assumes | electrons move independently in an effective mean field ⓘ |
| basisFor |
multi-determinant wavefunction expansions
ⓘ
single-determinant Hartree–Fock approximation ⓘ |
| belongsTo | fermionic Fock space ⓘ |
| constructedFrom |
one-electron orbitals
ⓘ
single-particle spin-orbitals ⓘ |
| differsFrom | Hartree product by antisymmetrization ⓘ |
| enforces | Pauli exclusion principle NERFINISHED ⓘ |
| ensures |
orthogonality of states built from orthonormal orbitals
ⓘ
proper antisymmetry of fermionic wavefunction ⓘ |
| generalizes | two-electron antisymmetric singlet wavefunction ⓘ |
| hasComponent |
spatial orbitals
ⓘ
spin degrees of freedom ⓘ |
| hasMathematicalForm |
1/sqrt(N!) times determinant of orbital matrix for N electrons
ⓘ
determinant of a matrix of spin-orbitals evaluated at electron coordinates ⓘ |
| hasProperty |
antisymmetric under exchange of any two electrons
ⓘ
changes sign under particle exchange ⓘ vanishes when two electrons occupy the same spin-orbital ⓘ |
| introducedBy | John C. Slater NERFINISHED ⓘ |
| introducedInField |
atomic physics
ⓘ
quantum chemistry ⓘ |
| namedAfter | John C. Slater NERFINISHED ⓘ |
| relatedTo | Hartree product NERFINISHED ⓘ |
| represents |
approximate ground-state wavefunction
ⓘ
excited-state wavefunction ⓘ fermionic Fock state in first quantization ⓘ independent-particle model of electrons ⓘ |
| usedAs |
basis function in configuration interaction expansions
ⓘ
reference state in Hartree–Fock theory ⓘ trial wavefunction in quantum Monte Carlo ⓘ trial wavefunction in variational calculations ⓘ |
| usedIn |
Hartree–Fock method
NERFINISHED
ⓘ
configuration interaction ⓘ molecular electronic structure theory ⓘ multi-configurational self-consistent field ⓘ n-electron atomic structure calculations ⓘ nuclear shell model ⓘ quantum Monte Carlo methods ⓘ second quantization formalism ⓘ |
How these facts were elicited
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Subject: Slater determinant Description of subject: A Slater determinant is an antisymmetrized many-electron wavefunction constructed from single-particle orbitals that enforces the Pauli exclusion principle in quantum chemistry and atomic physics.
Referenced by (1)
Full triples — surface form annotated when it differs from this entity's canonical label.