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Alexander Platonenko

University of Latvia

H指数:12

被引数:541

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Computational screening of halide perovskites for cross-luminescence applications via hybrid density functional theory

基于杂化密度泛函理论对卤化物钙钛矿进行用于交叉发光应用的计算筛选

Computational Condensed Matter

IF3.9

2026-07-010

PRE

Structural; Electronic; and Magnetic Properties of KCrF3: A Quantum-Mechanical Investigation

结构、电子和磁性性质研究：KCrF3的量子力学探究

Inorganic Chemistry

IF4.7

2026-04-160

PRE

The Structural, Electronic and Vibrational Properties of LaCrO3. A Quantum Mechanical Investigation by Using an All Electron Gaussian Type Basis Set and a Full Range Hybrid Functional

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2025-02-040

PRE

Cross-luminescence in BaF2 crystals doped with M3+and RE3+ions: Hybrid density functional theory study

COMPUTATIONAL MATERIALS SCIENCE

IF3.3

2025-01-010

PRE

Electronic Structure of Mg-, Si-, and Zn-Doped SnO2 Nanowires: Predictions from First Principles

Mg，Si和Zn掺杂的SnO2纳米线的电子结构: 第一性原理的预测

IF3.2

2024-05-070

OAAI

The energies and charge and spin distributions in the low-lying levels of singlet and triplet N2V defects in diamond from direct variational calculations of the excited states

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2024-01-172

PRE

Modeling of the Lattice Dynamics in Strontium Titanate Films of Various Thicknesses: Raman Scattering Studies

IF3.2

2023-09-141

OAAI

The Electronic Structures and Energies of the Lowest Excited States of the Ns0, Ns+, Ns- and Ns-H Defects in Diamond

IF3.2

2023-02-281

OAAI

Self-trapped excitons in diamond: A Δ-SCF approach

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-08-243

OA

Water Splitting on Multifaceted SrTiO3 Nanocrystals: Calculations of Raman Vibrational Spectrum

IF3.2

2022-06-155

OAAI

Vacancy Defects in Ga2O3: First-Principles Calculations of Electronic Structure

Ga2O3中的空位缺陷: 电子结构的第一性原理计算

IF3.2

2021-12-0252

OAAI

Oxygen and vacancy defects in silicon. A quantum mechanical characterization through the IR and Raman spectra

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2021-05-043

PREAI

Interstitial carbon defects in silicon. A quantum mechanical characterization through the infrared and Raman spectra

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2021-03-014

PREAI

First principles calculations of the vibrational properties of single and dimer F-type centers in corundum crystals

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2020-10-016

PREAI

Atomic, electronic and magnetic structure of an oxygen interstitial in neutron-irradiated Al2O3 single crystals

SCIENTIFIC REPORTS

IF3.9

2020-09-2820

OAAI

Interstitial defects in diamond: A quantum mechanical simulation of their EPR constants and vibrational spectra

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2020-07-138

OAAI

Substitutional carbon defects in silicon: A quantum mechanical characterization through the infrared and Raman spectra

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2020-04-109

OAAI

The VN2 negatively charged defect in diamond. A quantum mechanical investigation of the EPR response

IF11.6

2020-04-0117

OAAI

Structural and electronic properties of β-NaYF4 and β-NaYF4:Ce3+

OPTICAL MATERIALS

IF4.2

2020-01-019

OAAI

Nitrogen interstitial defects in silicon. A quantum mechanical investigation of the structural, electronic and vibrational properties

MATERIALS TODAY COMMUNICATIONS

IF4.5

2019-12-0112

OAAI