Related Experiment Video

Updated: Mar 17, 2026

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
12:11

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry

Published on: April 8, 2020

8.8K

Employing Range Separation on the meta-GGA Rung: New Functional Suitable for Both Covalent and Noncovalent

Marcin Modrzejewski1, Michal Hapka1, Grzegorz Chalasinski1

  • 1Faculty of Chemistry, University of Warsaw , 02-093 Warsaw, Pasteura 1, Poland.

Journal of Chemical Theory and Computation
|July 19, 2016
PubMed

More Related Videos

Density Gradient Multilayered Polymerization DGMP: A Novel Technique for Creating Multi-compartment, Customizable Scaffolds for Tissue Engineering12:54

Density Gradient Multilayered Polymerization DGMP: A Novel Technique for Creating Multi-compartment, Customizable Scaffolds for Tissue Engineering

Published on: February 12, 2013

13.0K
Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics10:52

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics

Published on: April 12, 2019

13.5K

Related Concept Videos

Gradient and Del Operator01:14

Gradient and Del Operator

In mathematics and physics, the gradient and del operator are fundamental concepts used to describe the behavior of functions and fields in space. The gradient is a mathematical operator that gives both the magnitude and direction of the maximum spatial rate of change. Consider a person standing on a mountain. The slope of the mountain at any given point is not defined unless it is quantified in a particular direction. For this reason, a "directional derivative" is defined, which is a vector...
4.8K
Model Approaches for Pharmacokinetic Data: Distributed Parameter Models01:06

Model Approaches for Pharmacokinetic Data: Distributed Parameter Models

Pharmacokinetic models are mathematical constructs that represent and predict the time course of drug concentrations in the body, providing meaningful pharmacokinetic parameters. These models are categorized into compartment, physiological, and distributed parameter models.
The distributed parameter models are specifically designed to account for variations and differences in some drug classes. This model is particularly useful for assessing regional concentrations of anticancer or...
309
State Function, Exact and Inexact Differentials01:27

State Function, Exact and Inexact Differentials

A state function is a thermodynamic property that depends solely on the current state of a system, irrespective of its history or how it arrived at that state. These functions are represented by capital letters, such as U, H, and S, which stand for internal energy, enthalpy, and entropy, respectively.For instance, the value of internal energy depends on the system's state variables and remains unaffected by the process path. This means that whether the system underwent a linear process or a...
64
Mechanistic Models: Compartment Models in Algorithms for Numerical Problem Solving01:29

Mechanistic Models: Compartment Models in Algorithms for Numerical Problem Solving

Mechanistic models play a crucial role in algorithms for numerical problem-solving, particularly in nonlinear mixed effects modeling (NMEM). These models aim to minimize specific objective functions by evaluating various parameter estimates, leading to the development of systematic algorithms. In some cases, linearization techniques approximate the model using linear equations.
In individual population analyses, different algorithms are employed, such as Cauchy's method, which uses a...
387
The Principle of Superposition and the Gravitational Field01:17

The Principle of Superposition and the Gravitational Field

The principle of superposition applies to gravitational forces of objects that are sufficiently far apart. It states that the net gravitational force on a point object is the vector sum of the gravitational forces on it due to various objects. The principle helps calculate the force by listing the individual forces and then vectorially summing them up. However, it should be noted that the principle of superposition is not always apparent. In the presence of a second force, the first force could...
2.2K
Gauss's Law01:07

Gauss's Law

If a closed surface does not have any charge inside where an electric field line can terminate, then the electric field line entering the surface at one point must necessarily exit at some other point of the surface. Therefore, if a closed surface does not have any charges inside the enclosed volume, then the electric flux through the surface is zero. What happens to the electric flux if there are some charges inside the enclosed volume? Gauss's law gives a quantitative answer to this question.
10.2K