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Crystal structure and thermoelectric properties of Sr-Mo substituted CaMnO3: a combined experimental and computational study

Journal of materials chemistry. C, Materials for optical and electronic devices, 2015-01, Vol.3 (47), p.12245-12259

2015

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Evaluation of correlated studies using liquid cell and cryo‐transmission electron microscopy: Hydration of calcium sulphate and the phase transformation pathways of bassanite to gypsum

Journal of microscopy (Oxford), 2022-12, Vol.288 (3), p.155-168

2022

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A transferable force-field for alkali metal nitrates

Journal of physics communications, 2022-05, Vol.6 (5), p.55011

2022

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Nanostructuring perovskite oxides: the impact of SrTiO3 nanocube 3D self-assembly on thermal conductivity

RSC advances, 2016-01, Vol.6 (115), p.114069-114077

2016

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A Giant Reconstruction of α-quartz (0001) Interpreted as Three Domains of Nano Dauphine Twins

Scientific reports, 2015-10, Vol.5 (1), p.14545-14545, Article 14545

2015

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Crystal structure and thermoelectric properties of Sr-Mo substituted CaMnO 3 : a combined experimental and computational study

Journal of materials chemistry. C, Materials for optical and electronic devices, 2015-12, Vol.3 (47), p.12245-12259

2015

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Nanostructuring perovskite oxides: the impact of SrTiO 3 nanocube 3D self-assembly on thermal conductivity

RSC advances, 2016, Vol.6 (115), p.114069-114077

2016

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Nanostructuring perovskite oxides: the impact of SrTiO3 nanocube 3D self-assembly on thermal conductivityElectronic supplementary information (ESI) available: Details of configurations and potential model. See DOI: 10.1039/c6ra23887d

2016-12

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A Giant Reconstruction of [alpha]-quartz (0001) Interpreted as Three Domains of Nano Dauphine Twins

Scientific reports, 2015-10, Vol.5, p.14545

2015

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Crystal structure and thermoelectric properties of Sr-Mo substituted CaMnO3: a combined experimental and computational studyElectronic supplementary information (ESI) available. See DOI: 10.1039/c5tc02318a

2015-11

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Crystal structure and thermoelectric properties of Sr–Mo substituted CaMnO3: a combined experimental and computational study† †Electronic supplementary information (ESI) available. See DOI: 10.1039/c5tc02318a

Journal of materials chemistry. C, Materials for optical and electronic devices, 2015-11, Vol.3 (47), p.12245-12259

2015

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Combined Experimental and Computational Study of Ce-Doped La3Zr2Li7O12 Garnet Solid-State Electrolyte

Chemistry of materials, 2020-01, Vol.32 (1), p.215-223

2020

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Structure and Lithium-Ion Dynamics in Fluoride-Doped Cubic Li7La3Zr2O12 (LLZO) Garnet for Li Solid-State Battery Applications

Journal of physical chemistry. C, 2018-12, Vol.122 (49), p.27811-27819

2018

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Li1.5La1.5MO6 (M = W6+, Te6+) as a new series of lithium-rich double perovskites for all-solid-state lithium-ion batteries

Nature communications, 2020-12, Vol.11 (1), p.6392-6392, Article 6392

2020

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A general method for calculating solid/liquid interfacial free energies from atomistic simulations: Application to CaSO4·xH2O

The Journal of chemical physics, 2022-08, Vol.157 (8), p.084117-084117

2022

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Concurrent La and A‑Site Vacancy Doping Modulates the Thermoelectric Response of SrTiO3: Experimental and Computational Evidence

ACS applied materials & interfaces, 2017-12, Vol.9 (48), p.41988-42000

2017

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The impact of tilt grain boundaries on the thermal transport in perovskite SrTiO3 layered nanostructures. A computational study

Nanoscale, 2018-08, Vol.10 (31), p.15010-15022

2018

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Enhanced Li-ion dynamics in trivalently doped lithium phosphidosilicate Li2SiP2: a candidate material as a solid Li electrolyte

Journal of materials chemistry. A, Materials for energy and sustainability, 2019-01, Vol.7 (8), p.3953-3961

2019

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Structure and Lithium-Ion Dynamics in Fluoride-Doped Cubic Li 7 La 3 Zr 2 O 12 (LLZO) Garnet for Li Solid-State Battery Applications

Journal of physical chemistry. C, 2018-12, Vol.122 (49), p.27811-27819

2018

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Structure and ion transport of lithium-rich Li1+xAlxTi2−x(PO4)3 with 0.3<x<0.5: A combined computational and experimental study

Solid state ionics, 2020-03, Vol.346, p.1, Article 115192

2020

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Li1.5La1.5 MO6 (M = W6+, Te6+) as a new series of lithium-rich double perovskites for all-solid-state lithium-ion batteries

Nature communications, 2020-12, Vol.11 (1), p.1-12

2020

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Halogenation of Li7La3Zr2O12 solid electrolytes: a combined solid-state NMR, computational and electrochemical study

Journal of materials chemistry. A, Materials for energy and sustainability, 2022-05, Vol.10 (20), p.11172-11185

2022

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The impact of tilt grain boundaries on the thermal transport in perovskite SrTiO 3 layered nanostructures. A computational study

Nanoscale, 2018-08, Vol.10 (31), p.15010-15022

2018

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Ionic Liquids: Design Parameters for Ionic Liquid–Molecular Solvent Blend Electrolytes to Enable Stable Li Metal Cycling Within Li–O2 Batteries (Adv. Funct. Mater. 27/2021)

Advanced functional materials, 2021-07, Vol.31 (27), p.n/a

2021

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Electron transparent nanotubes reveal crystallization pathways in confinement

Chemical science (Cambridge), 2023-06, Vol.14 (24), p.675-6715

2023

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Crystal structure and thermoelectric properties of Sr-Mo substituted CaMnO3: a combined experimental and computational study

Evaluation of correlated studies using liquid cell and cryo‐transmission electron microscopy: Hydration of calcium sulphate and the phase transformation pathways of bassanite to gypsum

A transferable force-field for alkali metal nitrates

Nanostructuring perovskite oxides: the impact of SrTiO3 nanocube 3D self-assembly on thermal conductivity

A Giant Reconstruction of α-quartz (0001) Interpreted as Three Domains of Nano Dauphine Twins

Crystal structure and thermoelectric properties of Sr-Mo substituted CaMnO 3 : a combined experimental and computational study

Nanostructuring perovskite oxides: the impact of SrTiO 3 nanocube 3D self-assembly on thermal conductivity

Nanostructuring perovskite oxides: the impact of SrTiO3 nanocube 3D self-assembly on thermal conductivityElectronic supplementary information (ESI) available: Details of configurations and potential model. See DOI: 10.1039/c6ra23887d

A Giant Reconstruction of [alpha]-quartz (0001) Interpreted as Three Domains of Nano Dauphine Twins

Crystal structure and thermoelectric properties of Sr-Mo substituted CaMnO3: a combined experimental and computational studyElectronic supplementary information (ESI) available. See DOI: 10.1039/c5tc02318a

Crystal structure and thermoelectric properties of Sr–Mo substituted CaMnO3: a combined experimental and computational study† †Electronic supplementary information (ESI) available. See DOI: 10.1039/c5tc02318a

Combined Experimental and Computational Study of Ce-Doped La3Zr2Li7O12 Garnet Solid-State Electrolyte

Structure and Lithium-Ion Dynamics in Fluoride-Doped Cubic Li7La3Zr2O12 (LLZO) Garnet for Li Solid-State Battery Applications

Li1.5La1.5MO6 (M = W6+, Te6+) as a new series of lithium-rich double perovskites for all-solid-state lithium-ion batteries

A general method for calculating solid/liquid interfacial free energies from atomistic simulations: Application to CaSO4·xH2O

Concurrent La and A‑Site Vacancy Doping Modulates the Thermoelectric Response of SrTiO3: Experimental and Computational Evidence

The impact of tilt grain boundaries on the thermal transport in perovskite SrTiO3 layered nanostructures. A computational study

Enhanced Li-ion dynamics in trivalently doped lithium phosphidosilicate Li2SiP2: a candidate material as a solid Li electrolyte

Structure and Lithium-Ion Dynamics in Fluoride-Doped Cubic Li 7 La 3 Zr 2 O 12 (LLZO) Garnet for Li Solid-State Battery Applications

Structure and ion transport of lithium-rich Li1+xAlxTi2−x(PO4)3 with 0.3<x<0.5: A combined computational and experimental study

Li1.5La1.5 MO6 (M = W6+, Te6+) as a new series of lithium-rich double perovskites for all-solid-state lithium-ion batteries

Halogenation of Li7La3Zr2O12 solid electrolytes: a combined solid-state NMR, computational and electrochemical study

The impact of tilt grain boundaries on the thermal transport in perovskite SrTiO 3 layered nanostructures. A computational study

Ionic Liquids: Design Parameters for Ionic Liquid–Molecular Solvent Blend Electrolytes to Enable Stable Li Metal Cycling Within Li–O2 Batteries (Adv. Funct. Mater. 27/2021)

Electron transparent nanotubes reveal crystallization pathways in confinement

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