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High-Pressure Vibrational and Structural Studies of the Chemically Engineered Ferroelectric Phase of Sodium Niobate

Crystals (Basel), 2023-08, Vol.13 (8), p.1181

2023

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Role of phonons in negative thermal expansion and high pressure phase transitions in β-eucryptite: An ab-initio lattice dynamics and inelastic neutron scattering study

Journal of applied physics, 2017-02, Vol.121 (8)

2017

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Dynamical and elastic properties of MgSiO3 perovskite (bridgmanite)

Geophysical research letters, 2016-03, Vol.43 (6), p.2568-2575

2016

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Nonlocal Probing of Amplitude Mode Dynamics in Charge-Density-Wave Phase of EuTe4

Ultrafast science, 2023-01, Vol.3

2023

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Phonons and Thermal Expansion Behavior of NiSi and NiGe

Frontiers in chemistry, 2018-08, Vol.6, p.331-331

2018

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Proton-polaron and thermionic identity of BaCeO3 polymorph for intermediate temperature fuel cell technology: A first principles and molecular dynamics approach

International journal of hydrogen energy, 2024-02, Vol.57, p.394-407

2024

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Anomalous Lattice Dynamics in AgC4N3: Insights From Inelastic Neutron Scattering and Density Functional Calculations

Frontiers in chemistry, 2018-11, Vol.6, p.544-544

2018

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Thermodynamic Properties of Solids: Experiment and Modeling

Thermodynamic Properties of Solids, 2010, p.1-5

1, 2010

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Phase transition mechanism of hexagonal graphite to hexagonal and cubic diamond: ab initio simulation

Journal of physics. Condensed matter, 2021-10, Vol.33 (42), p.425403

2021

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Quasi-One-Dimensional Fermi Surface Nesting and Hidden Nesting Enable Multiple Kohn Anomalies in α-Uranium

Physical review letters, 2021-03, Vol.126 (9), p.096401-096401, Article 096401

2021

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Scattering lifetime and high figure of merit in CsAgO predicted by methods beyond relaxation time approximation

Journal of physics. Condensed matter, 2022-07, Vol.34 (29), p.295502

2022

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Ultra-low thermal conductivity of orthorhombic CH3NH3SnI3: A first principles investigation

Journal of solid state chemistry, 2020-10, Vol.290, p.121541, Article 121541

2020

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Negative thermal expansion behavior in orthorhombic Sc2(MoO4)3 and Sc2(WO4)3

Journal of applied physics, 2019-09, Vol.126 (12)

2019

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Density Functional Studies Revealing Anomalous Lattice Behavior in Metal Cyanide, AgC 8 N 5

Journal of physical chemistry. C, 2018-07, Vol.122 (27), p.15575-15581

2018

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Anharmonic phonons and anomalous thermal expansion of graphite

Solid state communications, 2021-06, Vol.332, p.114324, Article 114324

2021

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Topological phonons and electronic structure of Li 2 BaSi class of semimetals

Journal of physics. Condensed matter, 2022-03, Vol.34 (12), p.125502

2022

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Ab initio molecular dynamics study of 1-D superionic conduction and phase transition in β-eucryptite

Journal of materials chemistry. A, Materials for energy and sustainability, 2018, Vol.6 (12), p.552-564

2018

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Topological phonons and low lattice thermal conductivity of Li 2 CaX (X = Sn and Pb) type Heusler compounds

Materials today communications, 2023-06, Vol.35, p.106289, Article 106289

2023

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Topological phonons and low lattice thermal conductivity of Li2CaX (X = Sn and Pb) type Heusler compounds

Materials today communications, 2023-06, Vol.35, Article 106289

2023

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Bulk and monolayer thermoelectric and optical properties of anisotropic NbS2Cl2

Materials today communications, 2023-03, Vol.34, Article 105309

2023

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Bulk and monolayer thermoelectric and optical properties of anisotropic NbS 2 Cl 2

Materials today communications, 2023-03, Vol.34, p.105309, Article 105309

2023

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Topology driven and soft phonon mode enabled Na-ion diffusion in quaternary chalcogenides, NaZnGaX (X = S, and Se)

Journal of materials chemistry. A, Materials for energy and sustainability, 2023-11, Vol.11 (44), p.2394-23949

2023

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Topology driven and soft phonon mode enabled Na-ion diffusion in quaternary chalcogenides, Na 3 ZnGaX 4 (X = S, and Se)

Journal of materials chemistry. A, Materials for energy and sustainability, 2023-11, Vol.11 (44), p.23940-23949

2023

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Distinct anharmonic characteristics of phonon-driven lattice thermal conductivity and thermal expansion in bulk MoSe 2 and WSe 2

Journal of materials chemistry. A, Materials for energy and sustainability, 2023-10, Vol.11 (40), p.21864-21873

2023

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Distinct anharmonic characteristics of phonon-driven lattice thermal conductivity and thermal expansion in bulk MoSe and WSe

Journal of materials chemistry. A, Materials for energy and sustainability, 2023-10, Vol.11 (4), p.21864-21873

2023

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High-Pressure Vibrational and Structural Studies of the Chemically Engineered Ferroelectric Phase of Sodium Niobate

Role of phonons in negative thermal expansion and high pressure phase transitions in β-eucryptite: An ab-initio lattice dynamics and inelastic neutron scattering study

Dynamical and elastic properties of MgSiO3 perovskite (bridgmanite)

Nonlocal Probing of Amplitude Mode Dynamics in Charge-Density-Wave Phase of EuTe4

Phonons and Thermal Expansion Behavior of NiSi and NiGe

Proton-polaron and thermionic identity of BaCeO3 polymorph for intermediate temperature fuel cell technology: A first principles and molecular dynamics approach

Anomalous Lattice Dynamics in AgC4N3: Insights From Inelastic Neutron Scattering and Density Functional Calculations

Thermodynamic Properties of Solids: Experiment and Modeling

Phase transition mechanism of hexagonal graphite to hexagonal and cubic diamond: ab initio simulation

Quasi-One-Dimensional Fermi Surface Nesting and Hidden Nesting Enable Multiple Kohn Anomalies in α-Uranium

Scattering lifetime and high figure of merit in CsAgO predicted by methods beyond relaxation time approximation

Ultra-low thermal conductivity of orthorhombic CH3NH3SnI3: A first principles investigation

Negative thermal expansion behavior in orthorhombic Sc2(MoO4)3 and Sc2(WO4)3

Density Functional Studies Revealing Anomalous Lattice Behavior in Metal Cyanide, AgC 8 N 5

Anharmonic phonons and anomalous thermal expansion of graphite

Topological phonons and electronic structure of Li 2 BaSi class of semimetals

Ab initio molecular dynamics study of 1-D superionic conduction and phase transition in β-eucryptite

Topological phonons and low lattice thermal conductivity of Li 2 CaX (X = Sn and Pb) type Heusler compounds

Topological phonons and low lattice thermal conductivity of Li2CaX (X = Sn and Pb) type Heusler compounds

Bulk and monolayer thermoelectric and optical properties of anisotropic NbS2Cl2

Bulk and monolayer thermoelectric and optical properties of anisotropic NbS 2 Cl 2

Topology driven and soft phonon mode enabled Na-ion diffusion in quaternary chalcogenides, NaZnGaX (X = S, and Se)

Topology driven and soft phonon mode enabled Na-ion diffusion in quaternary chalcogenides, Na 3 ZnGaX 4 (X = S, and Se)

Distinct anharmonic characteristics of phonon-driven lattice thermal conductivity and thermal expansion in bulk MoSe 2 and WSe 2

Distinct anharmonic characteristics of phonon-driven lattice thermal conductivity and thermal expansion in bulk MoSe and WSe

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