The following pages link to Forces in Molecules (Q5776523):
Displaying 50 items.
- Hellmann-Feynman connection for the relative Fisher information (Q305353) (← links)
- Compact submanifolds supporting singular interactions (Q306902) (← links)
- Quantum information entropies for the \(\ell \)-state Pöschl-Teller-type potential (Q338193) (← links)
- Virial theorem for angular displacement and torque (Q429909) (← links)
- Generalized Hellmann-Feynman theorem for ensemble average expressed in the formalism of pure state expectation (Q436980) (← links)
- The Hellmann-Feynman theorem for statistical averages (Q460963) (← links)
- On the crossing of the energy levels of a parameter-dependent quantum-mechanical Hamiltonian (Q488028) (← links)
- Fisher information, the Hellmann-Feynman theorem, and the Jaynes reciprocity relations (Q643653) (← links)
- Efficient first-principles calculations of the electronic structure of periodic systems (Q710174) (← links)
- Superconductivity near the normal state under the action of electric currents and induced magnetic fields in \(\mathbb R^2\) (Q711592) (← links)
- Ab initio molecular simulations with numeric atom-centered orbitals (Q711800) (← links)
- A Klein-Gordon particle captured by embedded curves (Q713999) (← links)
- Exact solutions of the Schrödinger equation for the pseudoharmonic potential: an application to some diatomic molecules (Q714673) (← links)
- On the making of quantum chemistry in Germany (Q720386) (← links)
- Effects of symmetry breaking in finite quantum systems (Q740801) (← links)
- Generalization of the Hellmann-Feynman theorem (Q763916) (← links)
- Comparison theorems for the position-dependent mass Schrödinger equation (Q764759) (← links)
- The reaction force. A scalar property to characterize reaction mechanisms (Q839369) (← links)
- Thermal effect for the mesoscopic LC circuits including complicated coupling by virtue of GHFT (Q842666) (← links)
- The balance between pleiotropic mutation and selection, when alleles have discrete effects (Q849469) (← links)
- Effective many-body interatomic potentials in molecular dynamic simulations (Q852168) (← links)
- Finite element approach for density functional theory calculations on locally-refined meshes (Q882089) (← links)
- Local approximation to the critical parameters of quantum wells (Q902548) (← links)
- Exactly complete solutions of the pseudoharmonic potential in \(N\)-dimensions (Q930190) (← links)
- Generalized Hellmann-Feynman theorem for coupled anisotropic two-mode Boson system (Q989854) (← links)
- A physically important class of integrals expressed as a parameter derivative (Q996351) (← links)
- Concurrent quantum/continuum coupling analysis of nanostructures (Q1013876) (← links)
- A note on the virtual crystal approach to alloy optimization (Q1028240) (← links)
- On the variation with respect to a parameter of zeros of Bessel and q- Bessel functions (Q1106374) (← links)
- General solution theory for Schrödinger's equation in arbitrary 2D- periodic spatial structures. I: The monolayer problem (Q1107716) (← links)
- Algebraic and numerical manipulation of the even-power-series central potentials by means of the hypervirial theorems technique (Q1301545) (← links)
- Properties of zeros of orthogonal polynomials and related functions (Q1318449) (← links)
- Application of the quantum mechanical hyperviral theorems to even-power series potentials (Q1380917) (← links)
- Applying the virial and Hellmann-Feynman theorems to the generalized \(q\)-symmetrized Harper equation (Q1396589) (← links)
- Pulay forces in density functional theory for periodic and molecular systems (Q1604998) (← links)
- Implementation of time-dependent density functional response equations (Q1612026) (← links)
- The ground state of long-range Schrödinger equations and static \( q\overline{q} \) potential (Q1638640) (← links)
- Pseudoscalar mesons in a finite cubic volume with twisted boundary conditions (Q1638976) (← links)
- Generalization of the Bogoliubov-Zubarev theorem for dynamic pressure to the case of compressibility (Q1646590) (← links)
- Adaptive local basis set for Kohn-Sham density functional theory in a discontinuous Galerkin framework. II: force, vibration, and molecular dynamics calculations (Q1685442) (← links)
- Topology of molecular electron density and electrostatic potential with DAMQT (Q1685832) (← links)
- Renormalisation group, trace anomaly and Feynman-Hellmann theorem (Q1694747) (← links)
- Disordered crystals from first principles. I: Quantifying the configuration space (Q1744275) (← links)
- Analysis of N-dimensional Klein-Gordon equation for hydrogen molecule in the non-central potential field (Q1798061) (← links)
- On the Hellmann-Feynman theorem and the variation of zeros of certain special functions (Q1825332) (← links)
- Efficient self-consistency for magnetic tight binding (Q1943164) (← links)
- Some properties of the potential-to-ground state map in quantum mechanics (Q2050076) (← links)
- A most misunderstood conditionally-solvable quantum-mechanical model (Q2058659) (← links)
- The bifunctional formalism: an alternative treatment of density functionals (Q2072194) (← links)
- Evolution of hybrid quantum-classical wavefunctions (Q2083708) (← links)
