Canyam
AI summaries for academic research
Home
Literature Help
Subscribe
Favorites
Tools
Analysis
Summary
Patents
Not logged in
Back
Journal Details
Electronic Structure
IF
2.4
Papers
63
Citations
566
Related Insights
0
subscribe
Journal Papers
59
Related Insights
0
Journal Papers
59
Publication Date
Publication Date
IF
Citations
Perspective on Moreau–Yosida regularization in density-functional theory
Electronic Structure
IF
2.4
2026-04-08
0
OA
AI
Markus Penz; Michael F Herbst; Trygve Helgaker; Andre Laestadius
Share
Save
Energetics; structural magic numbers; and vibrational modes of small carbon clusters Cn (n = 3–8): a comparative study of different ab initio methods and basis sets
Electronic Structure
IF
2.4
2026-04-02
0
PRE
AI
Angelo A Redoblado; Darwin B Putungan
Share
Save
Kinetic energy density functional: advances; challenges; and future directions
Electronic Structure
IF
2.4
2026-04-01
0
PRE
AI
Fahhad H Alharbi
Share
Save
Electronic structure and charge transition levels in oxygen deficient monoclinic zirconia
Electronic Structure
IF
2.4
2026-03-30
0
PRE
AI
Sanat Kumar Gogoi; Manish Jain
Share
Save
Defect-induced spin-split localized states with strong out-of-plane spin polarization in monolayer 1H-WSe2: DFT and $k \cdot p$ analysis
Electronic Structure
IF
2.4
2026-03-11
0
PRE
AI
Muhammad Oktavian Dharma Setyawan; Arif Lukmantoro; Moh Adhib Ulil Absor
Share
Save
Comprehensive characterization of Ag7PS6 crystal: structural; electronic; and mechanical properties
Electronic Structure
IF
2.4
2026-03-06
0
PRE
AI
T Babuka; A I Pogodin; M M Pop; M J Filep; T O Malakhovska
Share
Save
Electronic structure and defect chemistry of N-doped κ-Ga2O3: challenges toward P-type doping
Electronic Structure
IF
2.4
2026-02-26
0
PRE
AI
Wenyong Feng; Dayu Xiao; Paiwen Fang; Yiming Zhang; Houjian Lin; Zedong Lin; Jun Liang; Yanli Pei
Share
Save
A state-specific iterative decoupling scheme based on perturbation theory for low-energy electronic states
Electronic Structure
IF
2.4
2026-02-19
0
PRE
AI
Oussama Bindech; Saad Yalouz; Vincent Robert
Share
Save
2D materials beyond MXenes: recent progress; exotic properties; and future perspectives of alkaline earth metal based structures and their isoelectronic analogues
Electronic Structure
IF
2.4
2026-02-12
0
PRE
AI
Krishnanshu Basak; Subhadip Nath; Niladri Sekhar Mondal; Pabitra Mandal; Debnarayan Jana
Share
Save
An innovative linear-scaling method: integrating divide-and-conquer with fragment molecular approach via nonorthogonal localized orbitals for large systems
Electronic Structure
IF
2.4
2026-02-05
0
PRE
AI
JinYong Lin; Liang Peng; Daoling Peng; Feng Long Gu
Share
Save
Electrode-dependent spin and thermoelectric transport in M@C80 (M=Fe; Co; Ni) molecular junctions
Electronic Structure
IF
2.4
2026-02-04
0
PRE
AI
Alaa A Al-Jobory; Sameer Nawaf; Anhar A Ouda; Ali Ismael
Share
Save
The origin of metallic conductivity in Pt3O4: a first principles study
Electronic Structure
IF
2.4
2026-01-19
0
OA
AI
Akhil R Peeketi; Lavie Rekhi; Alexander R Muñoz; Rahul Jayan; Edward F Holby; Blas P Uberuaga; Travis E Jones
Share
Save
First-principles study on pressure induced structural and electronic properties of Mg$ _{1-x}$FexO using HSE06 and GGA + U methods; a combined study
Electronic Structure
IF
2.4
2026-01-07
0
PRE
AI
Kapil Sharma; Aleksandr Chernatynskiy
Share
Save
Generalized SSH model with staggered field
ELECTRONIC STRUCTURE
IF
2.4
2025-12-31
0
PRE
AI
Karnaukhov, Igor N.; Krasovskii, E. E.
Share
Save
Role of electron–electron correlations and disorder in the metal-insulator transition of SrTi$ _{1-x}$VxO3 thin films
Electronic Structure
IF
2.4
2025-12-22
0
OA
AI
J Laverock; A D N James; M Gu; J W Lu; K E Smith
Share
Save
Introduction to the fifth-rung density functional approximations: concept; formulation; and applications
Electronic Structure
IF
2.4
2025-11-24
0
OA
AI
Igor Ying Zhang; Rong Shi
Share
Save
Line shapes in time- and angle-resolved photoemission spectroscopy explored by machine learning
Electronic Structure
IF
2.4
2025-11-20
0
OA
AI
Tami C Meyer; Gesa-R Siemann; Paulina Majchrzak; Thomas Seyller; Jennifer Rigden; Yu Zhang; Emma Springate; Charlotte Sanders; Philip Hofmann
Share
Save
Optimization of ab-initio based tight-binding models
Electronic Structure
IF
2.4
2025-11-05
0
OA
AI
Henrik Dick; Thomas Dahm
Share
Save
High-entropy electrocatalysts toward high-performance oxygen evolution reaction: a perspective from atomic-scale electronic structure modulation
Electronic Structure
IF
2.4
2025-10-31
0
PRE
AI
Xiaoliang Zhang; Cong Li; Weibing Wu; Weiwei Li
Share
Save
Construction and accuracy of electronic continuum models of incommensurate bilayer 2D materials
Electronic Structure
IF
2.4
2025-09-25
0
PRE
AI
Xue Quan; Alexander B Watson; Daniel Massatt
Share
Save