Jove
Visualize
Contact Us
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

Baron Peters

8PUBLICATIONS
16CO-AUTHORS
Structural properties of condensed matterPyrometallurgyTheory and design of materialsTransport properties and non-equilibrium processesNuclear engineering (incl. fuel enrichment and waste processing and storage)
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (8)

Sort by Publication Date:
|May 04, 2021
Free energies of crystals computed using Einstein crystal with fixed center of mass and differing spring constants.

Vikram Khanna, Jamshed Anwar, Daan Frenkel

|Dec 31, 2020
Importance learning estimator for the site-averaged turnover frequency of a disordered solid catalyst.

Craig A Vandervelden, Salman A Khan, Baron Peters

|Dec 31, 2020
Diabat method for polymorph free energies: Extension to molecular crystals.

Kartik Kamat, Rui Guo, Susan M Reutzel-Edens

|Dec 09, 2020
Absolute chemical potentials for complex molecules in fluid phases: A centroid reference for predicting phase equilibria.

Vikram Khanna, Michael F Doherty, Baron Peters

|Aug 11, 2020
How fluxional reactants limit the accuracy/efficiency of infrequent metadynamics.

Salman A Khan, Bradley M Dickson, Baron Peters

|Jul 17, 2020
Solvent reaction coordinate for an S<sub>N</sub>2 reaction.

Christian Leitold, Christopher J Mundy, Marcel D Baer

Pageof 2

Frequent Collaborators

2 joint publications

Kartik Kamat

2 joint publications

Jamshed Anwar

2 joint publications

Christian Leitold

2 joint publications

Salman A Khan

2 joint publications

Vikram Khanna

2 joint publications

Michael F Doherty

1 joint publications

Ryan Yappert

1 joint publications

Christopher J Mundy

1 joint publications

Marcel D Baer

1 joint publications

Gregory K Schenter

Frequent Collaborators

2 joint publications

Kartik Kamat

2 joint publications

Jamshed Anwar

2 joint publications

Christian Leitold

2 joint publications

Salman A Khan

Top Related Videos

Characterization of Full Set Material Constants and Their Temperature Dependence for Piezoelectric Materials Using Resonant Ultrasound Spectroscopy
07:44

Characterization of Full Set Material Constants and Their Temperature Dependence for Piezoelectric Materials Using Resonant Ultrasound Spectroscopy

Published on : Apr 27, 2016

9.8K
Predicting Catalyst Extrudate Breakage Based on the Modulus of Rupture
09:53

Predicting Catalyst Extrudate Breakage Based on the Modulus of Rupture

Published on : May 13, 2018

8.5K
Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
06:37

Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package

Published on : Sep 17, 2021

4.8K
See more related videos

Top Related Videos

Characterization of Full Set Material Constants and Their Temperature Dependence for Piezoelectric Materials Using Resonant Ultrasound Spectroscopy
07:44

Characterization of Full Set Material Constants and Their Temperature Dependence for Piezoelectric Materials Using Resonant Ultrasound Spectroscopy

Published on : Apr 27, 2016

9.8K
Predicting Catalyst Extrudate Breakage Based on the Modulus of Rupture
09:53

Predicting Catalyst Extrudate Breakage Based on the Modulus of Rupture

Published on : May 13, 2018

8.5K
Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
06:37

Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package

Published on : Sep 17, 2021

4.8K
See more related videos