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functions Functions for Augmenting Basis Sets G-Spinor Basis Functions Gases basis” thermodynamic functions Gaussian Functions Basis Set Preliminaries Direct SCF Gaussian basis function Gaussian basis functions Hartree-Fock energies Gaussian basis functions contracted Gaussian basis functions electron correlation effects Gaussian basis functions many-electron molecules Gaussian basis functions polyatomic molecules Gaussian basis functions three-dimensional Gaussian basis sets polarization functions Gaussian functions, in basis set Gaussian primitive functions, even-tempered basis sets Gaussian-type basis functions Generating Representations from Basis Functions Geometric Basis and Functionality Group Product Functions and the Basis Orbitals Group from basis functions Hermite basis functions Hylleraas-type basis functions INDEX Diffuse basis function If the Basis Functions are Somewhere Negative Integrals over basis functions Introduction to Radial Basis Functions Inverse problems basis functions, choice Kernels Radial basis function Large component Gaussian 2-spinor basis functions Linear dependence of basis functions Liquids basis” thermodynamic functions Many-electron basis functions Minimal-basis-set wave function Molecular Basis Sets of Gaussian-type Functions Molecular function basis expansion Molecular orbitals basis function expansion Molecular quantum similarity basis functions Neglecting a Basis Function Neural network with radial basis functions Neural radial basis function Normalization basis functions Notation for Gaussian-type basis functions Nuclear Spin Basis Functions Numerical basis function Numerical basis functions anion Numerical methods basis function Off-Diagonal Matrix Elements of Total Hamiltonian between Unsymmetrized Basis Functions One-particle basis functions Orthogonalization basis functions Orthonormality basis functions Other Functional Series with Orthogonal Basis Sets Parameter-dependent basis functions Particle basis functions Phase factor from basis function symmetry Plane Waves and Atomic-like Basis Sets. Slater-type Functions Plane wave basis functions Polarisation/polarisable basis functions Polynomial basis functions Population Analysis Based on Basis Functions Population analysis basis functions Potential functions theoretical basis Primitive Cartesian Gaussian basis functions Primitive basis function Gaussian Primitive basis function matrix elements Primitive basis functions Product basis functions Quantum chemical equations particle basis functions Radial Basis Function (RBF) Radial Basis Function Interpolator Radial basis function , artificial Radial basis function collocation Radial basis function nets Radial basis function network training Radial basis function networks Radial basis function networks (RBF Radial basis function neural network RBFNN) Radial basis function neural networks Radial basis function technique Representations and Basis Functions Representations from basis functions Requirements on one-electron basis functions Rotational basis functions Rumer basis, spin functions Shells of basis functions Single coordinate basis functions Space of basis functions Special Choices of Basis Functions Special basis functions Spherical Gaussian basis functions Spinor Basis Function Structural Basis of Ion Channel Function Sturmian basis functions Symmetry Properties of Hunds Case (a) Basis Functions Symmetry Properties of non-Hunds Case (a) Basis Functions Symmetry-adapted basis functions Symmetry-adapted linear combinations basis functions System identification basis function The Basis Function The Basis State Functions Thermodynamic functions basis Tight-binding method basis functions Time-dependent basis functions Total angular momentum basis functions Transfer state function, constructing with basis functions Two-electron integrals over basis functions Types of Basis Functions Wave function analysis basis functions Wave function basis set Wavelet basis functions Weight basis probability density function What Basis Functions Do