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Sebastien Hamel

4PUBLICATIONS

9CO-AUTHORS

Theoretical quantum chemistryComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Experimental methods in fluid flow, heat and mass transferCondensed matter modelling and density functional theory

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Publications (4)

Sort by Publication Date:

|Jan 16, 2022

Accurate parameterization of the kinetic energy functional for calculations using exact-exchange.

Shashikant Kumar, Babak Sadigh, Siya Zhu

|Jul 28, 2020

Real-space formulation of the stress tensor for O(N) density functional theory: Application to high temperature calculations.

Abhiraj Sharma, Sebastien Hamel, Mandy Bethkenhagen

|Feb 24, 2019

Two-phase equation of state for lithium fluoride.

Philip C Myint, Eric L Shi, Sebastien Hamel

|Nov 23, 2017

Extraction of effective solid-liquid interfacial free energies for full 3D solid crystallites from equilibrium MD simulations.

L A Zepeda-Ruiz, B Sadigh, A A Chernov

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Frequent Collaborators

2 joint publications

Phanish Suryanarayana

1 joint publications

T Oppelstrup

1 joint publications

Amit Samanta

1 joint publications

Philip C Myint

1 joint publications

Eric L Shi

1 joint publications

Zsolt Jenei

1 joint publications

Magnus J Lipp

1 joint publications

William J Evans

1 joint publications

Minta C Akin

Frequent Collaborators

2 joint publications

Phanish Suryanarayana

1 joint publications

T Oppelstrup

1 joint publications

Amit Samanta

1 joint publications

Philip C Myint

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