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olyan sok Illetőleg Közönségesség j phys cond mat 24 386005 tengerszoros Házimunka Recepció

Materials | Free Full-Text | Electronic Structure and Optical Properties of  Inorganic Pm3m and Pnma CsPbX3 (X = Cl, Br, I) Perovskite: A Theoretical  Understanding from Density Functional Theory Calculations
Materials | Free Full-Text | Electronic Structure and Optical Properties of Inorganic Pm3m and Pnma CsPbX3 (X = Cl, Br, I) Perovskite: A Theoretical Understanding from Density Functional Theory Calculations

Evidence for chiral superconductivity on a silicon surface | Nature Physics
Evidence for chiral superconductivity on a silicon surface | Nature Physics

Förster-Induced Energy Transfer in Functionalized Graphene | The Journal of  Physical Chemistry C
Förster-Induced Energy Transfer in Functionalized Graphene | The Journal of Physical Chemistry C

Accuracy of Intermolecular interaction Energies, Particularly Those of  Hetero Atom Containing Molecules Obtained by van der Waals DFT Calculations  - Tsuzuki - 2023 - ChemistrySelect - Wiley Online Library
Accuracy of Intermolecular interaction Energies, Particularly Those of Hetero Atom Containing Molecules Obtained by van der Waals DFT Calculations - Tsuzuki - 2023 - ChemistrySelect - Wiley Online Library

Condensed Matter | Free Full-Text | Structural, Electronic, and Optical  Properties of Wurtzite VxAl1−xN Alloys: A First-Principles Study
Condensed Matter | Free Full-Text | Structural, Electronic, and Optical Properties of Wurtzite VxAl1−xN Alloys: A First-Principles Study

Condensed Matter | Free Full-Text | Ab Initio Study of the Electronic,  Vibrational, and Mechanical Properties of the Magnesium Diboride Monolayer
Condensed Matter | Free Full-Text | Ab Initio Study of the Electronic, Vibrational, and Mechanical Properties of the Magnesium Diboride Monolayer

Condensed Matter | Free Full-Text | Properties of Blue Phosphorene  Nanoribbon-P3HT Polymer Heterostructures: DFT First Principles Calculations
Condensed Matter | Free Full-Text | Properties of Blue Phosphorene Nanoribbon-P3HT Polymer Heterostructures: DFT First Principles Calculations

PDF) Screening nature of the van der Waals density functional method: a  review and analysis of the many-body physics foundation
PDF) Screening nature of the van der Waals density functional method: a review and analysis of the many-body physics foundation

IJMS | Free Full-Text | Review of Applications of Density Functional Theory  (DFT) Quantum Mechanical Calculations to Study the High-Pressure Polymorphs  of Organic Crystalline Materials
IJMS | Free Full-Text | Review of Applications of Density Functional Theory (DFT) Quantum Mechanical Calculations to Study the High-Pressure Polymorphs of Organic Crystalline Materials

IJMS | Free Full-Text | Amyloid-β Tetramers and Divalent Cations at  the Membrane/Water Interface: Simple Models Support a Functional Role
IJMS | Free Full-Text | Amyloid-β Tetramers and Divalent Cations at the Membrane/Water Interface: Simple Models Support a Functional Role

Full article: Density-functional tight-binding: basic concepts and  applications to molecules and clusters
Full article: Density-functional tight-binding: basic concepts and applications to molecules and clusters

Pressure Induced Semiconductor-Semimetal Transition in WSe2 | The Journal  of Physical Chemistry C
Pressure Induced Semiconductor-Semimetal Transition in WSe2 | The Journal of Physical Chemistry C

IJMS | Free Full-Text | A Density Functional Theory (DFT) Perspective on  Optical Absorption of Modified Graphene Interacting with the Main Amino  Acids of Spider Silk
IJMS | Free Full-Text | A Density Functional Theory (DFT) Perspective on Optical Absorption of Modified Graphene Interacting with the Main Amino Acids of Spider Silk

Entropy | Free Full-Text | A Computational Quantum-Based Perspective on the  Molecular Origins of Life’s Building Blocks
Entropy | Free Full-Text | A Computational Quantum-Based Perspective on the Molecular Origins of Life’s Building Blocks

Crossed Luttinger liquid hidden in a quasi-two-dimensional material |  Nature Physics
Crossed Luttinger liquid hidden in a quasi-two-dimensional material | Nature Physics

Strain-tunable Berry curvature in quasi-two-dimensional chromium telluride  | Nature Communications
Strain-tunable Berry curvature in quasi-two-dimensional chromium telluride | Nature Communications

The PYXAID Program for Non-Adiabatic Molecular Dynamics in Condensed Matter  Systems | Journal of Chemical Theory and Computation
The PYXAID Program for Non-Adiabatic Molecular Dynamics in Condensed Matter Systems | Journal of Chemical Theory and Computation

Chirality locking charge density waves in a chiral crystal | Nature  Communications
Chirality locking charge density waves in a chiral crystal | Nature Communications

Stable Structural Phase of Potassium-Doped p-Terphenyl and Its  Semiconducting State | The Journal of Physical Chemistry C
Stable Structural Phase of Potassium-Doped p-Terphenyl and Its Semiconducting State | The Journal of Physical Chemistry C

Theoretical Predictions of Freestanding Honeycomb Sheets of Cadmium  Chalcogenides | The Journal of Physical Chemistry C
Theoretical Predictions of Freestanding Honeycomb Sheets of Cadmium Chalcogenides | The Journal of Physical Chemistry C

Connection between water's dynamical and structural properties: Insights  from ab initio simulations | PNAS
Connection between water's dynamical and structural properties: Insights from ab initio simulations | PNAS

Evidence of pseudogravitational distortions of the Fermi surface geometry  in the antiferromagnetic metal FeRh | Communications Physics
Evidence of pseudogravitational distortions of the Fermi surface geometry in the antiferromagnetic metal FeRh | Communications Physics