Volume 16; Issue 2

Main
Journal of Chemical Theory and Computation
Volume 16; Issue 2

Journal of Chemical Theory and Computation

Volume 16; Issue 2

1

Numerical Approach to Nonequilibrium Quantum Thermodynamics: Nonperturbative Treatment of the Driven Resonant Level Model Based on the Driven Liouville von-Neumann Formalism

Oz, Annabelle, Hod, Oded, Nitzan, Abraham

Journal:

Journal of Chemical Theory and Computation

Year:

2020

File:

PDF, 1.35 MB

2020

2

Nonadiabatic Dynamics in a Laser Field: Using Floquet Fewest Switches Surface Hopping To Calculate Electronic Populations for Slow Nuclear Velocities

Zhou, Zeyu, Chen, Hsing-Ta, Nitzan, Abraham, Subotnik, Joseph Eli

Journal:

Journal of Chemical Theory and Computation

Year:

2020

File:

PDF, 3.06 MB

2020

3

A Multiple Filter Based Neural Network Approach to the Extrapolation of Adsorption Energies on Metal Surfaces for Catalysis Applications

Chowdhury, Asif J., Yang, Wenqiang, Abdelfatah, Kareem E., Zare, Mehdi, Heyden, Andreas, Terejanu, Gabriel A.

Journal:

Journal of Chemical Theory and Computation

Year:

2020

File:

PDF, 2.65 MB

2020

4

Using Density Matrix Quantum Monte Carlo for Calculating Exact-on-Average Energies for ab Initio Hamiltonians in a Finite Basis Set

Petras, Hayley R., Ramadugu, Sai Kumar, Malone, Fionn D., Shepherd, James J.

Journal:

Journal of Chemical Theory and Computation

Year:

2020

Language:

english

File:

PDF, 1.06 MB

english, 2020

5

Issue Publication Information

Journal:

Journal of Chemical Theory and Computation

Year:

2020

File:

PDF, 168 KB

2020

6

Issue Editorial Masthead

Journal:

Journal of Chemical Theory and Computation

Year:

2020

File:

PDF, 133 KB

2020

To build up a library is to create a life. It’s never just a random collection of books.

— Carlos María Domínguez

Official channel

Z-Library Desktop Launcher

Tor version

Z-Library

Z-Library Since 2009 support@1delivery.pm

EnglishРусскийEspañolItalianoελληνικάاللغة العربيةBahasa IndonesiaBahasa Malaysiaहिन्दीDeutschFrançaisPortuguêsУкраїнськаPolski中文繁體中文日本語Tiếng ViệtAzərbaycan DiliՀայոց լեզուภาษาไทยTürk Diliქართველიবাংলাپښتوతెలుగుاردو한국어SrpskiБългарски