List of works - Taku Tsuchiya

A New Era of High-Pressure Earth Science Opened by First Principles Computations

scientific article published in 2020

A new high-pressure structure of SiO 2 directly converted from α-quartz under nonhydrostatic compression

scientific article published on 26 May 2022

Ab Initio Computation Study for Earth and Planetary Physics

scientific article published in 2013

Ab Initio Mineralogical Model of the Earth's Lower Mantle

scientific article published on 24 March 2013

Ab Initio Molecular–Dynamics Study of Structural and Bonding Properties of Liquid Fe–Light–Element–O Systems Under High Pressure

scientific article published on 25 April 2022

Ab Initio Study on the Lower Mantle Minerals

scientific article published on 30 May 2020

Ab Initio Thermoelasticity of Liquid Iron-Nickel-Light Element Alloys

scientific article published on 9 January 2020

Ab initio investigation into the elasticity of ultrahigh-pressure phases of SiO2

scientific article published on 13 December 2011

Ab initio investigation of high-pressure phase relation and elasticity in the NaAlSi 2 O 6 system

scientific article published in September 2010

Ab initio investigation on the high-temperature thermodynamic properties of Fe3+-bearing MgSiO3 perovskite

scientific article

Ab initio lattice thermal conductivity of MgO from a complete solution of the linearized Boltzmann transport equation

scientific article published on 16 May 2017

Ab initio two-phase molecular dynamics on the melting curve of SiO2

scientific article published in October 2010

Ab initioLattice Thermal Conductivity ofMgSiO3Perovskite as Found in Earth’s Lower Mantle ⬇️

scientific article published on January 11, 2013

Atomic transport property of Fe–O liquid alloys in the Earth’s outer core P, T condition

scientific article published in October 2015

Computational support for a pyrolitic lower mantle containing ferric iron

Constraints on Earth's inner core composition inferred from measurements of the sound velocity of hcp-iron in extreme conditions

scientific article

Correction to “Unified analyses forP-V-Tequation of state of MgO: A solution for pressure-scale problems in highP-Texperiments”

scientific article

Creation of the ab initio theoretical high-pressure mineral physics

scientific article published in 2015

Crystal structure of the high-pressure phase of calcium hydroxide, portlandite: In situ powder and single-crystal X-ray diffraction study

scholarly article in American Mineralogist, vol. 98 no. 8-9, August 2013

Dense yttria phase eclipsing the A-type sesquioxide structure: high-pressure experiments and ab initio calculations

scientific article published on 01 May 2010

Editorial

scientific article published on 21 December 2012

Editorial

Effect of hydrogen on the melting temperature of FeS at high pressure: Implications for the core of Ganymede

scholarly article

Effects of Si on the elastic property of Fe at Earth's inner core pressures: First principles study

scientific article published in May 2009

Elastic properties of δ-AlOOH under pressure: First principles investigation

scientific article published in May 2009

Elastic, vibrational, and thermodynamic properties of MgGeO 3 postperovskite investigated by first principles simulation

scientific article published on 4 March 2010

Elasticity of Continental Crust Around the Mantle Transition Zone

scientific article published in 2015

Elasticity of subducted basaltic crust at the lower mantle pressures: Insights on the nature of deep mantle heterogeneity

scientific article published in October 2011

Equation of State of Liquid Iron under Extreme Conditions

scientific article published on 01 April 2020

Erratum: First-principles prediction of a high-pressure hydrous phase of AlOOH [Phys. Rev. B 83 , 054115 (2011)]

scientific article published on 14 April 2011

Expanding-contracting Earth

scientific article published in May 2013

First Principles Calculation of the Stability of Iron Bearing Carbonates at High Pressure Conditions

scientific article published on 8 January 2020

First principles calculation of the elasticity of ice VIII and X.

scientific article published in January 2017

First principles determination of the phase boundaries of high-pressure polymorphs of silica

scholarly article

First principles investigation of the structural and elastic properties of hydrous wadsleyite under pressure

scientific article published on 13 February 2009

First principles investigations on the elasticity and phase stability of grossular garnet

scientific article published in February 2012

First principles prediction of new high-pressure phase of InOOH

article published in 2008

First-principles Study on Crystal Structures and Elasticity of Pure Iron and Iron-light Element Alloys at the Earth's Inner Core

scientific article published in 2011

First-principles prediction of a high-pressure hydrous phase of AlOOH

scientific article published on 24 February 2011

First-principles prediction of post-pyrite phase transitions in germanium dioxide

scientific article published on 12 April 2011

First-principles study on the high-pressure phase transition and elasticity of KAlSi3O8 hollandite

scientific article published on 20 December 2012

Helium and Argon Partitioning Between Liquid Iron and Silicate Melt at High Pressure

scientific article published on 3 February 2021

High pressure and high temperature phase transitions of FeO

scholarly article

High-P, T phase relations in the NaAlSi2O6 system from first principles computation

scientific article published on 9 February 2012

High-pressure phase transition to the Gd(2)S(3) structure in Sc(2)O(3): a new trend in dense structures in sesquioxides

scientific article

High-pressure phases of calcium: Prediction of phase VI and upper-pressure phases from first principles

scientific article published on 31 March 2010

High-pressure, high-temperature deformation of CaGeO3(perovskite)±MgO aggregates: Implications for multiphase rheology of the lower mantle

Laser-shock compression of magnesium oxide in the warm-dense-matter regime.

scientific article published on 17 August 2015

Lattice dynamics and thermodynamic properties of (Mg,Fe 2+ )SiO 3 postperovskite

scientific article published on 10 August 2011

Lattice dynamics calculations for ferropericlase with internally consistent LDA+Umethod

scientific article

Melting and metallization of silica in the cores of gas giants, ice giants, and super Earths

scholarly article in Physical Review B, vol. 92 no. 1, July 2015

Molecular dynamics simulation for evaluating melting point of wurtzite-type GaN crystal

article

Novel configurations of VN4 and VN4H defects in diamond platelets: Structure, energetics and vibrational properties

scientific article published in October 2020

P-V-T equation of state of cubic CaSiO3 perovskite from first-principles computation

scientific article

Phase Transitions and Melting in Magnesium Oxide

scholarly article published 2017

Phase Transitions and Mineralogy of the Lower Mantle

scientific article published in 2015

Phase stability and elastic properties of the NAL and CF phases in the NaMg2Al5SiO12 system from first principles

scientific article published on 30 January 2012

Postperovskite phase transition of ZnGeO3: comparative crystal chemistry of postperovskite phase transition from germanate perovskites

scientific article

Prediction of a hexagonal SiO 2 phase affecting stabilities of MgSiO 3 and CaSiO 3 at multimegabar pressures ⬇️

scientific article published on January 5, 2011

Pressure dependence of transverse acoustic phonon energy in ferropericlase across the spin transition

scientific article published on 28 April 2017

Review of high pressure phases of calcium by first-principles calculations

scientific article published in March 2010

Scale-Free Unified Analyses to Determine Primary P-V-T Equations of State of Materials

Seismological Evidence for Laterally Heterogeneous Lowermost Outer Core of the Earth

scientific article

Shear response of Fe-bearing MgSiO<sub>3</sub> post-perovskite at lower mantle pressures ⬇️

scientific article published on January 1, 2013

Small shear modulus of cubic CaSiO 3 perovskite

scientific article published on 21 April 2015

Stacking-disordered phase of iron in the Earth’s inner core from first principles

scientific article published on 17 June 2011

Structural refinements of high-pressure phases in germanium dioxide

scientific article

Structures of Liquid Iron–Light‐Element Mixtures under High Pressure

scientific article published on 8 April 2020

Temperature of the Lower Mantle and Core Based on Ab Initio Mineral Physics Data

scientific article published on 5 March 2016

Temperature profile in the lowermost mantle from seismological and mineral physics joint modeling

scientific article

The melting points of MgO up to 4 TPa predicted based on the <i>ab initio</i> thermodynamic integration molecular dynamics.

scientific article

The pyrite-type high-pressure form of FeOOH.

scientific article

The second continent: Existence of granitic continental materials around the bottom of the mantle transition zone

scientific article published in January 2013

TheP-V-Tequation of state and thermodynamic properties of liquid iron

scientific article

Theoretical and experimental evidence for a new post-cotunnite phase of titanium dioxide with significant optical absorption

scientific article published on 22 July 2011

Thermodynamic properties of (Mg,Fe2+)SiO3 perovskite at the lower-mantle pressures and temperatures: an internally consistent LSDA+U study

scientific article

Ultrahigh-pressure scales for gold and platinum at pressures up to 550 GPa

scholarly article in Physical Review B, vol. 80 no. 10, September 2009

Vacancies in MgO at ultrahigh pressure: About mantle rheology of super-Earths

scientific article published in May 2018

Viscosity of hcp iron at Earth's inner core conditions from density functional theory

scientific article published on 14 April 2020

List of works by Taku Tsuchiya

A New Era of High-Pressure Earth Science Opened by First Principles Computations

A new high-pressure structure of SiO 2 directly converted from α-quartz under nonhydrostatic compression

Ab Initio Computation Study for Earth and Planetary Physics

Ab Initio Mineralogical Model of the Earth's Lower Mantle

Ab Initio Molecular–Dynamics Study of Structural and Bonding Properties of Liquid Fe–Light–Element–O Systems Under High Pressure

Ab Initio Study on the Lower Mantle Minerals

Ab Initio Thermoelasticity of Liquid Iron-Nickel-Light Element Alloys

Ab initio investigation into the elasticity of ultrahigh-pressure phases of SiO2

Ab initio investigation of high-pressure phase relation and elasticity in the NaAlSi 2 O 6 system

Ab initio investigation on the high-temperature thermodynamic properties of Fe3+-bearing MgSiO3 perovskite

Ab initio lattice thermal conductivity of MgO from a complete solution of the linearized Boltzmann transport equation

Ab initio two-phase molecular dynamics on the melting curve of SiO2

Ab initioLattice Thermal Conductivity ofMgSiO3Perovskite as Found in Earth’s Lower Mantle ⬇️

Atomic transport property of Fe–O liquid alloys in the Earth’s outer core P, T condition

Computational support for a pyrolitic lower mantle containing ferric iron

Constraints on Earth's inner core composition inferred from measurements of the sound velocity of hcp-iron in extreme conditions

Correction to “Unified analyses forP-V-Tequation of state of MgO: A solution for pressure-scale problems in highP-Texperiments”

Creation of the ab initio theoretical high-pressure mineral physics

Crystal structure of the high-pressure phase of calcium hydroxide, portlandite: In situ powder and single-crystal X-ray diffraction study

Dense yttria phase eclipsing the A-type sesquioxide structure: high-pressure experiments and ab initio calculations

Editorial

Editorial

Effect of hydrogen on the melting temperature of FeS at high pressure: Implications for the core of Ganymede

Effects of Si on the elastic property of Fe at Earth's inner core pressures: First principles study

Elastic properties of δ-AlOOH under pressure: First principles investigation

Elastic, vibrational, and thermodynamic properties of MgGeO 3 postperovskite investigated by first principles simulation

Elasticity of Continental Crust Around the Mantle Transition Zone

Elasticity of subducted basaltic crust at the lower mantle pressures: Insights on the nature of deep mantle heterogeneity

Equation of State of Liquid Iron under Extreme Conditions

Erratum: First-principles prediction of a high-pressure hydrous phase of AlOOH [Phys. Rev. B 83 , 054115 (2011)]

Expanding-contracting Earth

First Principles Calculation of the Stability of Iron Bearing Carbonates at High Pressure Conditions

First principles calculation of the elasticity of ice VIII and X.

First principles determination of the phase boundaries of high-pressure polymorphs of silica

First principles investigation of the structural and elastic properties of hydrous wadsleyite under pressure

First principles investigations on the elasticity and phase stability of grossular garnet

First principles prediction of new high-pressure phase of InOOH

First-principles Study on Crystal Structures and Elasticity of Pure Iron and Iron-light Element Alloys at the Earth's Inner Core

First-principles prediction of a high-pressure hydrous phase of AlOOH

First-principles prediction of post-pyrite phase transitions in germanium dioxide

First-principles study on the high-pressure phase transition and elasticity of KAlSi3O8 hollandite

Helium and Argon Partitioning Between Liquid Iron and Silicate Melt at High Pressure

High pressure and high temperature phase transitions of FeO

High-P, T phase relations in the NaAlSi2O6 system from first principles computation

High-pressure phase transition to the Gd(2)S(3) structure in Sc(2)O(3): a new trend in dense structures in sesquioxides

High-pressure phases of calcium: Prediction of phase VI and upper-pressure phases from first principles

High-pressure, high-temperature deformation of CaGeO3(perovskite)±MgO aggregates: Implications for multiphase rheology of the lower mantle

Laser-shock compression of magnesium oxide in the warm-dense-matter regime.

Lattice dynamics and thermodynamic properties of (Mg,Fe 2+ )SiO 3 postperovskite

Lattice dynamics calculations for ferropericlase with internally consistent LDA+Umethod

Melting and metallization of silica in the cores of gas giants, ice giants, and super Earths

Molecular dynamics simulation for evaluating melting point of wurtzite-type GaN crystal

Novel configurations of VN4 and VN4H defects in diamond platelets: Structure, energetics and vibrational properties

P-V-T equation of state of cubic CaSiO3 perovskite from first-principles computation

Phase Transitions and Melting in Magnesium Oxide

Phase Transitions and Mineralogy of the Lower Mantle

Phase stability and elastic properties of the NAL and CF phases in the NaMg2Al5SiO12 system from first principles

Postperovskite phase transition of ZnGeO3: comparative crystal chemistry of postperovskite phase transition from germanate perovskites

Prediction of a hexagonal SiO 2 phase affecting stabilities of MgSiO 3 and CaSiO 3 at multimegabar pressures ⬇️

Pressure dependence of transverse acoustic phonon energy in ferropericlase across the spin transition

Review of high pressure phases of calcium by first-principles calculations

Scale-Free Unified Analyses to Determine Primary P-V-T Equations of State of Materials

Seismological Evidence for Laterally Heterogeneous Lowermost Outer Core of the Earth

Shear response of Fe-bearing MgSiO&lt;sub&gt;3&lt;/sub&gt; post-perovskite at lower mantle pressures ⬇️

Small shear modulus of cubic CaSiO 3 perovskite

Stacking-disordered phase of iron in the Earth’s inner core from first principles

Structural refinements of high-pressure phases in germanium dioxide

Structures of Liquid Iron–Light‐Element Mixtures under High Pressure

Temperature of the Lower Mantle and Core Based on Ab Initio Mineral Physics Data

Temperature profile in the lowermost mantle from seismological and mineral physics joint modeling

The melting points of MgO up to 4 TPa predicted based on the <i>ab initio</i> thermodynamic integration molecular dynamics.

The pyrite-type high-pressure form of FeOOH.

The second continent: Existence of granitic continental materials around the bottom of the mantle transition zone

TheP-V-Tequation of state and thermodynamic properties of liquid iron

Theoretical and experimental evidence for a new post-cotunnite phase of titanium dioxide with significant optical absorption

Thermodynamic properties of (Mg,Fe2+)SiO3 perovskite at the lower-mantle pressures and temperatures: an internally consistent LSDA+U study

Ultrahigh-pressure scales for gold and platinum at pressures up to 550 GPa

Vacancies in MgO at ultrahigh pressure: About mantle rheology of super-Earths

Viscosity of hcp iron at Earth's inner core conditions from density functional theory

Shear response of Fe-bearing MgSiO<sub>3</sub> post-perovskite at lower mantle pressures ⬇️