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Literature DB >> 9975508

Theory of the crystal structures of selenium and tellurium: The effect of generalized-gradient corrections to the local-density approximation.

Abstract

Entities: Chemical

Year: 1994 PMID： 9975508 DOI： 10.1103/physrevb.50.13181

Source DB: PubMed Journal: Phys Rev B Condens Matter ISSN： 0163-1829

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14 in total

1. Phase Transformation in TiNi Nano-Wafers for Nanomechanical Devices with Shape Memory Effect.

Authors: Alexey Kartsev; Peter V Lega; Andrey P Orlov; Alexander I Pavlov; Svetlana von Gratowski; Victor V Koledov; Alexei S Ilin
Journal: Nanomaterials (Basel) Date: 2022-03-28 Impact factor: 5.076

2. Formation of toroidal Li₂O₂ in non-aqueous Li-O₂ batteries with Mo₂CT _x MXene/CNT composite.

Authors: Mihye Wu; Do Youb Kim; Hyunsoo Park; Kyeong Min Cho; Ju Ye Kim; Seon Joon Kim; Sungho Choi; Yongku Kang; Jihan Kim; Hee-Tae Jung
Journal: RSC Adv Date: 2019-12-16 Impact factor: 4.036

3. Computational Design of α-AsP/γ-AsP Vertical Two-Dimensional Homojunction for Photovoltaic Applications.

Authors: Yuliang Mao; Yuting Du; Zhipeng Huang; Guanhua Zhang; Jianmei Yuan
Journal: Nanomaterials (Basel) Date: 2022-05-13 Impact factor: 5.719

4. An unusually short inter-molecular N-H⋯N hydrogen bond in crystals of the hemi-hydro-chloride salt of 1-exo-acetamido-pyrrolizidine.

Authors: Minakshi Bhardwaj; Qianxiang Ai; Sean R Parkin; Robert B Grossman
Journal: Acta Crystallogr E Crystallogr Commun Date: 2020-01-01

5. Ternary Cu₂SnS₃: Synthesis, Structure, Photoelectrochemical Activity, and Heterojunction Band Offset and Alignment.

Authors: Sagar B Jathar; Sachin R Rondiya; Yogesh A Jadhav; Dhanaraj S Nilegave; Russell W Cross; Sunil V Barma; Mamta P Nasane; Shankar A Gaware; Bharat R Bade; Sandesh R Jadkar; Adinath M Funde; Nelson Y Dzade
Journal: Chem Mater Date: 2021-03-03 Impact factor: 9.811

Theory of the crystal structures of selenium and tellurium: The effect of generalized-gradient corrections to the local-density approximation.

1. Phase Transformation in TiNi Nano-Wafers for Nanomechanical Devices with Shape Memory Effect.

2. Formation of toroidal Li₂O₂ in non-aqueous Li-O₂ batteries with Mo₂CT _x MXene/CNT composite.

3. Computational Design of α-AsP/γ-AsP Vertical Two-Dimensional Homojunction for Photovoltaic Applications.

4. An unusually short inter-molecular N-H⋯N hydrogen bond in crystals of the hemi-hydro-chloride salt of 1-exo-acetamido-pyrrolizidine.

5. Ternary Cu₂SnS₃: Synthesis, Structure, Photoelectrochemical Activity, and Heterojunction Band Offset and Alignment.

6. Porous Co₂VO₄ Nanodisk as a High-Energy and Fast-Charging Anode for Lithium-Ion Batteries.

7. Strain-tunable magnetic anisotropy in two-dimensional Dirac half-metals: nickel trihalides.

Review 8. A review on the use of DFT for the prediction of the properties of nanomaterials.

9. Manipulation of the Magnetic Properties of Janus WSSe Monolayer by the Adsorption of Transition Metal Atoms.

10. The Shape of Native Plant Cellulose Microfibrils.