Search results
Results from the WOW.Com Content Network
In computational chemistry, a constraint algorithm is a method for satisfying the Newtonian motion of a rigid body which consists of mass points. A restraint algorithm is used to ensure that the distance between mass points is maintained.
The Newton loop-node method is based on Kirchhoff’s first and second laws. The Newton loop-node method is the combination of the Newton nodal and loop methods and does not solve loop equations explicitly. The loop equations are transformed to an equivalent set of nodal equations, which are then solved to yield the nodal pressures.
Newton's law of viscosity is the simplest relationship between the flux of momentum and the velocity gradient. It may be useful to note that this is an unconventional use of the symbol τ zx; the indices are reversed as compared with standard usage in solid mechanics, and the sign is reversed. [11]
In fluid dynamics, the Kirchhoff equations, named after Gustav Kirchhoff, describe the motion of a rigid body in an ideal fluid. = + + +, = + +, = (~ +) = ^, = ^ where and are the angular and linear velocity vectors at the point , respectively; ~ is the moment of inertia tensor, is the body's mass; ^ is a unit normal vector to the surface of the body at the point ; is a pressure at this point ...
The method is applied mostly in chemical physics, materials science, and biophysics. Because molecular systems typically consist of a vast number of particles, it is impossible to determine the properties of such complex systems analytically; MD simulation circumvents this problem by using numerical methods.
In physics, reduced mass is a measure of the effective inertial mass of a system with two or more particles when the particles are interacting with each other. Reduced mass allows the two-body problem to be solved as if it were a one-body problem. Note, however, that the mass determining the gravitational force is not reduced.
In order to increase the calculation speed for viscosity calculations based on CS theory, which is important in e.g. compositional reservoir simulations, while keeping the accuracy of the CS method, Pedersen et al. (1984, 1987, 1989) [17] [18] [2] proposed a CS method that uses a simple (or conventional) CS formula when calculating the reduced ...
A force field is used to minimize the bond stretching energy of this ethane molecule.. Molecular mechanics uses classical mechanics to model molecular systems. The Born–Oppenheimer approximation is assumed valid and the potential energy of all systems is calculated as a function of the nuclear coordinates using force fields.