Jove
Visualize
Contact Us

Related Concept Videos

Thermodynamic Potentials01:26

Thermodynamic Potentials

1.5K
Thermodynamic potentials are state functions that are extremely useful in analyzing a thermodynamic system. They have dimensions of energy. The four important thermodynamic potentials are internal energy, enthalpy, Helmholtz free energy, and Gibbs free energy. These thermodynamic potentials can be expressed using two of the following variables: pressure, volume, temperature, and entropy. These two variables are expressed as the rate of change of the thermodynamic potential with respect to other...
1.5K
Path Between Thermodynamics States01:21

Path Between Thermodynamics States

3.9K
Consider the two thermodynamic processes involving an ideal gas that are represented by paths AC and ABC in Figure 1:
3.9K
Thermodynamic Systems01:06

Thermodynamic Systems

7.5K
A thermodynamic system is a set of objects whose thermodynamic properties are of interest. The system is considered to be embedded in its surroundings or the environment. The system and its environment can exchange heat and do work on each other through a boundary that separates them. However, the immediate surroundings of the system interact with it directly and therefore have a much stronger influence on its behavior and properties.
Consider an example of  tea boiling in a kettle. The...
7.5K
Constant Pressure Calorimetry03:02

Constant Pressure Calorimetry

97.2K
Calorimetry is a technique used to measure the amount of heat involved in a chemical or physical process or to measure the heat transferred to or from a substance. The heat is exchanged with a calibrated and insulated device called the calorimeter. Calorimetry experiments are based on the assumption that there is no heat exchange between the insulated calorimeter and the external environment. The well-insulated calorimeters prevent the transfer of heat between the calorimeter and its external...
97.2K
Pressure of Fluids01:14

Pressure of Fluids

21.7K
There are many examples of pressure in fluids in everyday life, such as in relation to blood (high or low blood pressure) and in relation to weather (high- and low-pressure weather systems). A given force can have a significantly different effect, depending on the area over which the force is exerted. For instance, a force applied to an area of 1 mm2 has a pressure that is 100 times greater than the same force applied to an area of 1 cm2. That's why a sharp needle is able to poke through...
21.7K
Pressure Variation in a Fluid at Rest01:11

Pressure Variation in a Fluid at Rest

739
In a fluid at rest, the pressure at any point beneath the fluid surface depends solely on the depth, not on the container's shape or size. This principle, known as hydrostatic pressure, arises because, in stationary fluids, there is no acceleration, meaning the forces within the fluid balance out. Only vertical forces, caused by the weight of the fluid above, contribute to pressure changes with depth.
When measuring pressure at two different levels within the fluid, the difference in...
739

You might also read

Related Articles

Articles linked to this work by shared authors, journal, and citation graph.

Sort by
Same author

Context-dependent peptide recognition shapes tyrosine kinase substrate specificity beyond consensus motifs.

bioRxiv : the preprint server for biology·2026
Same author

A Hidden Binding Pocket in the β- ketoacyl-ACP Synthase FabB.

bioRxiv : the preprint server for biology·2026
Same author

Developing and Benchmarking Sage 2.3.0 with the AshGC Neural Network Charge Model.

Journal of chemical theory and computation·2026
Same author

Biofabrication of <i>Leucas aspera</i>-Mediated Chitosan-Zinc Oxide Nanocomposites for In Vitro Antioxidant, Antibacterial, Anti-Inflammatory and Wound-Healing Properties.

Pharmaceutics·2026
Same author

Inhalable Therapeutics in Lung Cancer: Overcoming Barriers for Effective Treatment.

AAPS PharmSciTech·2026
Same author

Decoding iNOS Inhibition: A Computational Voyage of Tavaborole Toward Restoring Endothelial Homeostasis in Venous Leg Ulcers.

Pharmaceuticals (Basel, Switzerland)·2026
JoVE
x logofacebook logolinkedin logoyoutube logo
ABOUT JoVE
OverviewLeadershipBlogJoVE Help Center
AUTHORS
Publishing ProcessEditorial BoardScope & PoliciesPeer ReviewFAQSubmit
LIBRARIANS
TestimonialsSubscriptionsAccessResourcesLibrary Advisory BoardFAQ
RESEARCH
JoVE JournalMethods CollectionsJoVE Encyclopedia of ExperimentsArchive
EDUCATION
JoVE CoreJoVE BusinessJoVE Science EducationJoVE Lab ManualFaculty Resource CenterFaculty Site
Terms & Conditions of Use
Privacy Policy
Policies

Related Experiment Video

Updated: Jan 17, 2026

A Modeling and Simulation Method for Preliminary Design of an Electro-Variable Displacement Pump
09:04

A Modeling and Simulation Method for Preliminary Design of an Electro-Variable Displacement Pump

Published on: June 1, 2022

3.6K

GOPAL: A Water Model with Improved Thermodynamic Properties over a Large Pressure and Temperature Range Optimized

Himanshu Paliwal1, Michael R Shirts2

  • 1Department of Chemical Engineering, Indian Institute of Technology Ropar, Rupnagar, Punjab 140001, India.

Journal of Chemical Theory and Computation
|September 16, 2025
PubMed
Summary

Efficient algorithms optimize molecular models using thermodynamic data. New methods drastically cut computation time for accurate water models across wide temperature and pressure ranges.

More Related Videos

Author Spotlight: Optimization of Airflow Velocities in Battery Cooling Systems for Enhanced Thermal Performance and Reduced Energy Consumption
10:36

Author Spotlight: Optimization of Airflow Velocities in Battery Cooling Systems for Enhanced Thermal Performance and Reduced Energy Consumption

Published on: November 3, 2023

2.1K
Parametric Optimization Design Method for Friction Plates of Hydro-Viscous Clutches
10:58

Parametric Optimization Design Method for Friction Plates of Hydro-Viscous Clutches

Published on: July 22, 2025

609

Related Experiment Videos

Last Updated: Jan 17, 2026

A Modeling and Simulation Method for Preliminary Design of an Electro-Variable Displacement Pump
09:04

A Modeling and Simulation Method for Preliminary Design of an Electro-Variable Displacement Pump

Published on: June 1, 2022

3.6K
Author Spotlight: Optimization of Airflow Velocities in Battery Cooling Systems for Enhanced Thermal Performance and Reduced Energy Consumption
10:36

Author Spotlight: Optimization of Airflow Velocities in Battery Cooling Systems for Enhanced Thermal Performance and Reduced Energy Consumption

Published on: November 3, 2023

2.1K
Parametric Optimization Design Method for Friction Plates of Hydro-Viscous Clutches
10:58

Parametric Optimization Design Method for Friction Plates of Hydro-Viscous Clutches

Published on: July 22, 2025

609

Area of Science:

  • Computational chemistry
  • Molecular modeling
  • Thermodynamics

Background:

  • Optimizing molecular models requires extensive computational resources.
  • Accurate thermodynamic properties are crucial for molecular model validation.
  • Existing methods struggle with large-scale parameterization across broad conditions.

Purpose of the Study:

  • To develop and demonstrate efficient algorithms for molecular model optimization.
  • To parameterize a rigid water model across wide temperature and pressure ranges.
  • To improve the accuracy and efficiency of molecular simulations.

Main Methods:

  • Utilized reweighting and configuration mapping algorithms for optimization.
  • Performed multidimensional, multiobjective parameterization of a rigid water model.
  • Incorporated thermodynamic properties and Gibbs energy derivatives into the objective function.

Main Results:

  • Reduced computational time from 250 CPU years to four CPU months.
  • Achieved a water model reproducing liquid phase density within 0.02% experimental uncertainty.
  • Developed the most accurate rigid water model to date across extensive temperature and pressure ranges.

Conclusions:

  • Efficient algorithms enable accurate molecular model optimization across broad conditions.
  • The developed water model demonstrates high fidelity in thermodynamic and kinetic properties.
  • Simple point charge models can capture complex temperature- and pressure-dependent behavior effectively.