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Address: Institut Mines-Télécom Atlantique, 4 rue Alfred Kastler, La Chantrerie CS 20722, 44307 Nantes, France
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SPIN-RSCI: 6720-5485
ORCID: 0000-0003-0743-4242
ResearcherID: B-4519-2008
Scopus AuthorID: 7005601520
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G. Norman
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Andrey G. Kalinichev

  • Andrey G. Kalinichev has been at HSE since 2017.

Education and Degrees

  • 1986

    Candidate of Sciences* (PhD) in Chemical Physics, Burning and Explosion, Physics of Extreme Conditions
    Thesis Title: "Computer simulation of thermodynamic properties of geochemical fluids at high temperatures and pressures"

  • 1979

    Degree in Engineering Thermophysics
    Odessa Technological Institute of Refrigerating Industry

* Candidate of Sciences
According to the International Standard Classification of Education (ISCED) 2011, Candidate of Sciences belongs to ISCED level 8 - "doctoral or equivalent", together with PhD, DPhil, D.Lit, D.Sc, LL.D, Doctorate or similar. Candidate of Sciences allows its holders to reach the level of the Associate Professor.

Publications21

Conferences

  • 2018
    ShaleXenvironmenT Dissemination Event (Doha). Presentation: Adsorption and Transport of Naturally Occurring Radioactive Materials (NORMs) in Clays — Atomistic Computational Modeling Approach
  • 2nd Workshop "Calcium Silicate Hydrates containing Aluminium: C‐A‐S‐H" (Dübendorf). Presentation: Atomistic Modeling of the Structure and Dynamics of Water and Ions in Calcium Silicate Hydrate and Calcium Aluminate Hydrate Phases
  • 55th Annual Meeting of the Clay Minerals Society (Urbana). Presentation: Interaction of Naturally Occurring Radioactive Materials (NORMs) with Clay Minerals iin the Context of Shale Gas Exploration
  • Conference Cluster on the Problems of Solvation, Complex Formation in Solutions, Crystallization, and Smart Materials (Suzdal). Presentation: Atomistic Computational Modeling of Confined Aqueous Fluids in Natural and Synthetic Nanostructured Materials Relevant to Energy, Environmental, and Geochemical Applications
  • Conference Cluster on the Problems of Solvation, Complex Formation in Solutions, Crystallization, and Smart Materials (Suzdal). Presentation: ClayFF Force Field and its Application for Atomistic Modeling of Nanoporous Materials and their Aqueous Interfaces
  • Goldschmidt-2018 Conference (Boston). Presentation: Atomistic Computational Modeling of Contaminant Cation Adsorption at the Edge Surfaces of Clays
  • 256th National Meeting of the American Chemical Society (Boston). Presentation: Adsorption of Radionuclide Cations on Clay Minerals - Atomistic Computational Modeling of the Basal and edge Surfaces
  • XV РОССИЙСКАЯ КОНФЕРЕНЦИЯ (с международным участием) ПО ТЕПЛОФИЗИЧЕСКИМ СВОЙСТВАМ ВЕЩЕСТВ (РКТС-15) (Москва). Presentation: Новые возможности силового поля ClayFF для атомистического компьютерного моделирования природных и синтезированных нанопористых материалов и их гидратированных поверхностей
  • 2017
    Nanocem Workshop – Atomistic Simulation in Cementitious Systems (Les Diablerets). Presentation: Molecular simulations of cementitious materials with ClayFF
  • REIMEI International Workshop: "Radionuclides Remediation and Clean-Up" (Нант). Presentation: Computational Molecular Modeling of Materials and Processes Relevant for Geological Disposal of Radioactive Waste
  • SXT -ShaleXenvironmenT European Consortium Reveiw Meeting (Флоренция). Presentation: Research activities of the work package 4 "Modelling of Confined Fluids"
  • AIPEA School for Young Scientists "COMPUTATIONAL MODELING IN CLAY MINERALOGY" (Granada). Presentation: Molecular Dynamics Simulations of Clays and Related Materials with ClayFF
  • 16th International Clay Conference (Granada). Presentation: HYDROPHOBICITY OF SMECTITE SURFACES PROBED BY MOLECULAR DYNAMICS SIMULATIONS
  • 16th International Clay Conference (Granada). Presentation: FORCE FIELD PARAMETERIZATION FOR ACCURATE MOLECULAR MODELING OF CLAY EDGES IN CLASSICAL MD SIMULATIONS
  • Goldschmidt-2017 Conference (Париж). Presentation: Invited: Recent Improvements in ClayFF and Future Challenges for Classical Molecular Simulations of Nano-Confined Water in Minerals

  • Goldschmidt-2017 Conference (Париж). Presentation: Intercalation of CO2 and H2O in Na-Hectorite Under Geological Carbon Sequestration Conditions Using GCMD Simulations

  • H2020 Shale gas projects clustering workshop (Брюссель). Presentation: Work Package 4 "Modelling of Confined Fluids" of the H2020 ShaleXenvironmenT project
  • International Conference on Computer Simulation in Physics and beyond (Москва). Presentation: Computational Molecular Modeling of Aqueous Interfaces for Environmental and Materials Science Applications

Editorial board membership

  • 2018: Member of the Editorial Board, Сверхкритические флюиды: Теория и практика.

  • 2013: Member of the Editorial Board (Associate Editor), Clays and Clay Minerals.

  • 2008: Member of the Editorial Council, Троицкий вариант. Наука.

  • 2015–2017: Guest Editor (Special Issue "Supercritical fluids - theory and applications" dedicated to Prof. Yu. E. Gorbaty), Journal of Molecular Liquids.

  • 2014–2016: Guest Editor (Special issue "Molecular computer simulations of clays and clay-water interfaces"), Clays and Clay Minerals.

Employment history

2010- date    Directeur de Recherche, Laboratoire Subatech (UMR 6457 - Institut Mines-Telecom Atlantique, Université de Nantes, CNRS/IN2P3), Nantes, FRANCE

2007- 2012   Research Associate Professor, Adjunct Professor, Department of Chemistry, Department of Geological Sciences, Michigan State University, USA

2000-2007   Research Associate Professor, Senior Research Scientist, Department of Geology, University of Illinois at Urbana-Champaign, USA

1998-2000   Visiting Senior Research Scientist / Visiting Assistant Professor, Department of Geology, Department of Chemistry, University of Illinois at Urbana-Champaign, USA

1994-2000   Head, Physical Research Laboratory, Institute of Experimental Mineralogy, Russian Academy of Sciences, Chernogolovka, Moscow Region, RUSSIA

1992-1994   Visiting Research Associate, Department of Geology, Department of Materials Science and Engineereing, University of Illinois at Urbana-Champaign, USA

1991-1994   Head, Computer Modeling Research Group, Inst. of Experimental Mineralogy, Russian Academy of Sciences, Chernogolovka, Moscow Region, RUSSIA

1989-1991   Alexander von Humboldt Research Fellow, Research Group of Physical Chemistry, Max-Planck-Institut für Chemie (Otto-Hahn-Institut), Mainz, GERMANY

1979-1989   Research Associate, Senior Research Associate, Laboratory of Hydrothermal Processes, Institute of Experimental Mineralogy, Russian Academy of Sciences, Chernogolovka, RUSSIA


Recent professional activities

Vice PresidentThe Clay Minerals Society (2018 - present)

Member of the Editorial Board Supercritical Fluids: Theory and Practice (2018 - present)

Associate EditorClays and Clay Minerals (2014 - present)

Guest EditorMinerals, Special Issue “Molecular Simulation of Mineral-Solution Interfaces” (2016-2018)

Guest EditorJournal of Molecular Liquids, Special Issue “Supercritical fluids: Theory and applications” (2015-2017)

Organizer and Co-Chairman, Special Session 22A “Multiscale modeling of mineral-fluid interaction”, Goldschmidt-2017 Conference, Paris, France, August 13-18, 2017.

Organizer and Co-Chairman – Special Session “Computational modeling of clay minerals and related materials”, 16th International Clay Conference, July 17 - 21, 2017, Granada, Spain

Co-Organizer and Lecturer – AIPEA School for Young Scientists “Computational modeling in clay mineralogy”, July 15 - 16, 2017, Granada, Spain

Organizer and Co-Chairman – Special Session “(Bio-)geochemistry of layered materials: From molecular-scale structure and reactivity to field-scale environmental and engineering applications” Goldschmidt-2016 Conference, June 26 – July 1, 2016, Yokohama, Japan

Co-Editor – The Geological Society of London Special Publication SP400: “Clays in Natural and Engineered Barriers for Radioactive Waste Confinement” (2013-2014)

Organizer and Co-Chairman - Special Session “Molecular simulation of clay minerals and reactions”, 51th Annual Meeting of the Clay Minerals Society, May 17-21 2014, College Station, TX, USA

Organizer and Co-Chairman - Special Session “Modeling the interface: Mineralogy, environment and energy applications”, 247th American Chemical Society National Meeting, March 16-20 2014, Dallas, TX, USA

Member of the Scientific Committee – 5th International Meeting “Clays in Natural & Engineered Barriers for Radioactive Waste Confinement”, Montpellier, France (2011-2012)

Workshop "Supercomputer technologies and atomistic modeling"

The regular workshop organized by theInternational Laboratory for Supercomputer Atomistic Modelling and Multi-scale Analysis presented reports on the modern development of supercomputer technologies, on the HSE supercomputer, and on the results of solving various real problems using atomic modeling.

Laboratory members took part in the HSE science festival "Lunokhod-1"

On October 27, Higher School of Economics held the Lunokhod-1 science festival in the Digital October convention centre. Our laboratory presented an interactive supercomputer demonstration booth at the event. D.Sc. V.V.Stagailov delivered a popular science report “Why do we need supercomputers, how to design and use them?”.

Database clarifies bottom-up design of cement

An international team of scientists led by EPFL Lausanne, ETH Zurich and Rice University has created a database of molecular dynamics models that simulate the properties of cement in all its varieties.