Abstracts

Área: Modelling & simulation - The 27th international Conference on High Pressure Science and Technology

ARTIFICIAL INTELLIGENCE METHODS FOR PROBING MATTER AT EXTREME CONDITIONS
Artem Oganov (SKOLTECH - Skolkovo Institute of Science and Technology )

Area: Modelling & simulation

[Abstract]

CHAIN-MELTED PHASE OF MATTER AND THE ALKALI METALS
Victor Naden Robinson (ICTP - The International Centre for Theoretical Physics, UOE - The University of Edinburgh, CSEC) ; Hongxiang Zong (XIAN - State Key Laboratory for Mechanical Behavior of Materials, Xi’an Jiantong University, UOE - The University of Edinburgh, CSEC) ; Graeme Ackland (UOE - The University of Edinburgh, CSEC) ; Gavin Woolman (UOE - The University of Edinburgh, CSEC) ; Andreas Hermann (UOE - The University of Edinburgh, CSEC)

Area: Modelling & simulation

[Abstract]

COMPUTATIONAL STUDY OF URANIUM AND URANIUM HYDRIDES AT HIGH PRESSURES
Ivan Kruglov (VNIIA - Dukhov Research Institute of Automatics, MIPT - Moscow Institute of Physics and Technology) ; Artem Oganov (SKOLTECH - Skolkovo Institute of Science and Technology, MIPT - Moscow Institute of Physics and Technology, VNIIA - Dukhov Research Institute of Automatics) ; Alexander Kvashnin (SKOLTECH - Skolkovo Institute of Science and Technology, MIPT - Moscow Institute of Physics and Technology) ; Alexey Yanilkin (VNIIA - Dukhov Research Institute of Automatics, MIPT - Moscow Institute of Physics and Technology) ; Alexander Goncharov (INSTITUTE OF SOLID STATE PHYSICS CAS - Institute of Solid State Physics CAS, CARNEGIE INSTITUTION OF WASHINGTON - Carnegie Institution of Washington)

Area: Modelling & simulation

[Abstract]

DENSITY FUNCTIONAL THEORY CALCULATION OF THE EQUATION OF STATE OF RHENIUM IN THE TERAPASCAL REGIME
Giovani Luis Rech (UCS - Universidade de Caxias do Sul) ; Janete Eunice Zorzi (UCS - Universidade de Caxias do Sul) ; Cláudio Antônio Perottoni (UCS - Universidade de Caxias do Sul)

Area: Modelling & simulation

[Abstract]

HIGH PRESSURE BEHAVIOUR OF AGGASE2 CHALCOPYRITE FROM AB INITIO SIMULATIONS
Sergio Rodríguez-peña (ULL - Universidad de La Laguna) ; Plácida Rodriguez-hernández (ULL - Universidad de La Laguna) ; Alfonso Muñoz González (ULL - Universidad de La Laguna)

Area: Modelling & simulation

[Abstract]

HIGH-PRESSURE MELTING OF BERYLLIUM FROM QUANTUM MOLECULAR DYNAMICS SIMULATIONS
Shuaichuang Wang (IAPCM - Institute of Applied Physics and Computational Mathematics) ; Haifeng Song (IAPCM - Institute of Applied Physics and Computational Mathematics) ; Gongmu Zhang (IAPCM - Institute of Applied Physics and Computational Mathematics) ; Haifeng Liu (IAPCM - Institute of Applied Physics and Computational Mathematics)

Area: Modelling & simulation

[Abstract]

HIGH-PRESSURE PHASE TRANSFORMATIONS UNDER NONHYDROSTATIC CONDITIONS AND PLASTIC FLOW: FOUR-SCALE THEORY, PHENOMENA, AND INTERPRETATION OF EXPERIMENTS
Valery Levitas (ISU - Iowa State Univerisity)

Area: Modelling & simulation

[Abstract]

PREDICTED PRESSURE-INDUCED SUPERCONDUCTING TRANSITION IN ELECTRIDE LI6P
Ziyuan Zhao (NENU - Centre for Advanced Optoelectronic Functional Materials Research and Laboratory for UV Light-Emitting Materials and Technology of Ministry of Education, Northeast Normal University) ; Shoutao Zhang (NENU - Centre for Advanced Optoelectronic Functional Materials Research and Laboratory for UV Light-Emitting Materials and Technology of Ministry of Education, Northeast Normal University) ; Tong Yu (NENU - Centre for Advanced Optoelectronic Functional Materials Research and Laboratory for UV Light-Emitting Materials and Technology of Ministry of Education, Northeast Normal University) ; Haiyang Xu (NENU - Centre for Advanced Optoelectronic Functional Materials Research and Laboratory for UV Light-Emitting Materials and Technology of Ministry of Education, Northeast Normal University) ; Guochun Yang (NENU - Centre for Advanced Optoelectronic Functional Materials Research and Laboratory for UV Light-Emitting Materials and Technology of Ministry of Education, Northeast Normal University) ; Aitor Bergara (UPV/EHU - Condensed Matter Physics Department, University of the Basque Country, DIPC - Donostia International Physics Center, CFM - Materials Physics Center)

Area: Modelling & simulation

[Abstract]

STRUCTURAL EVOLUTION OF AMORPHOUS POLYMERIC NITROGEN FROM AB INITIO MOLECULAR DYNAMICS SIMULATIONS AND EVOLUTIONARY SEARCH
Dominika Melicherová (COM - Comenius University in Bratislava) ; Oto Kohulák (COM - Comenius University in Bratislava) ; Dušan Plašienka (COM - Comenius University in Bratislava) ; Roman Martonak (COM - Comenius University in Bratislava)

Area: Modelling & simulation

[Abstract]

TEMPERATURE EFFECTS ON THE STRUCTURAL PHASE TRANSITIONS OF GALLIUM PHOSPHIDE
Cesar Isidoro dos S. R. Silva (UFRJ - Universidade Federal do Rio de Janeiro) ; Adalberto Picinin (UFSCAR - Universidade federal de São Carlos) ; José Pedro Rino (UFSCAR - Universidade federal de São Carlos) ; Marcos G. Menezes (UFRJ - Universidade Federal do Rio de Janeiro) ; Rodrigo B. Capaz (UFRJ - Universidade Federal do Rio de Janeiro)

Area: Modelling & simulation

[Abstract]

THE STRUCTURE OF OXIDE GLASSES AT HIGH PRESSURE
John Tse (UOFS - University of Saskatchewan)

Area: Modelling & simulation

[Abstract]

THEORETICAL STUDIES OF THE THERMODYNAMIC PROPERTIES AND OPTICAL PROPERTIES OF LIF UNDER HIGH PRESSURE
Hongzhou Song (IAPCM - INSTITUTE OF APPLIED PHYSICS AND COMPUTATIONAL MATHEMATICS)

Area: Modelling & simulation

[Abstract]

VISCOSITY OF CARBONATE MELTS AT HIGH PRESSURES AND TEMPERATURES
Min Wu (ZJUT - Zhejiang University of Technology)

Area: Modelling & simulation

[Abstract]