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Collection : University Of Liege
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Academic Journal

Structural chirality and natural optical activity across the α to β phase transition in SiO2 and AlPO4 from first principles

Subjects: optical activity; DFT; Quartz

  • Source: Journal of Applied Crystallography, 59 (1), 225-231 (2026-02-01)

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Academic Journal

First-Principles Investigations of the Structural Phases of Low-Spin State of BiCoO3

Subjects: density-functional theory (DFT) calculations; multiferroics; perovskites

  • Source: Physica Status Solidi B. Basic Research, 261 (8), 2400131 (2024-08)

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Academic Journal

Systematic determination of a material’s magnetic ground state from first principles

Subjects: Computer Science Applications; General Materials Science; Modeling and Simulation

  • Source: npj Computational Materials, 10 (1), 20 (2024-01-23)

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Academic Journal

Engineering magnetic domain wall energies in BiFeO3 via epitaxial strain: A route to assess skyrmionic stabilities in multiferroics from first principles

Subjects: Antiferromagnetics; Domain wall energy; Energy

  • Source: Physical Review. B, 109 (18) (2024-05)

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Academic Journal

Excitonic response in transition metal dichalcogenide heterostructures from first principles: Impact of stacking, twisting, and interlayer distance

Subjects: Energy; Excitonic response; First principles

  • Source: Physical Review. B, 110 (3) (2024-07-15)

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Conference

Promoting children physical activity and movement through the PAMIA principles ; Promotion de l'activité physique et du mouvement chez les enfants grâce aux principes PAMIA

  • Authors : Cloes, Marc; Kropp, Alex; RUCHE - Research Unit for a life-Course perspective on Health & Education - ULiège

Subjects: Children; Lifestyle; Motivation

  • Source: CIAPSE Congress: Holistic approaches to childhood development, Zürich, Switzerland [CH], September 3-5

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Academic Journal

Member States’ Discretion in Emergency Pesticide Authorisations: The Role of the EU Principles of Good Administration and the Precautionary Principle in Shaping Better National Administrative Practices

Subjects: Law; criminology & political science; European & international law

  • Source: Nordic Journal of European Law, 8 (1), 70-101 (2025-04-03)

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Academic Journal

Structural phase transitions and dielectric properties of BaTiO3 from a second-principles method.

Subjects: phase transitions; dielectric properties; BaTiO3

  • Source: Physical Review. B (108), 134117 (2023-10-26)

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Academic Journal

Displacive phase transitions in infinite-layer nickelates from first- and second-principles calculations.

Subjects: displacive phase; infinite-layer; nickelates

  • Source: Physical Review. B (108), 165117 (2023-10-12)

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Academic Journal

Ferroelectric properties and topological polar textures of PbTiO 3 from a second-principles open-source interatomic potential

Subjects: Physical; chemical; mathematical & earth Sciences

  • Source: Physical Review. B, 112 (14) (2025-10-03)

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  • 1-10 of  786 results for ""Principles""