activity
20132026
most citedInterplay of octahedral rotations and breathing distortions in charge ordering perovskite oxides

100 citations · 511 across the 17 of their papers we have counts for

collaborators

18 papers

hep-ph2026

Precision QCD with the Electron-Ion Collider

C. Alexandrou, M. Arratia, E. C. Aschenauer +66

This document summarizes the discussions at the program "Precision QCD with the Electron Ion Collider", held from May to June 2025 at the Institute for Nuclear Theory (INT) at the…

cond-mat.mtrl-sci2026

Constrained Diffusion for Accelerated Structure Relaxation of Inorganic Solids with Point Defects

Jingyi Cui, Jacob K. Christopher, Ankita Biswas +2

Point defects affect material properties by altering electronic states and modifying local bonding environments. However, high-throughput first-principles simulations of point defe…

cs.LG2026

Are LLMs Ready for Neural-integrated Mechanistic Modeling? A Benchmark and Agentic Framework

Zihan Guan, Rituparna Datta, Mengxuan Hu +5

Large language models (LLMs) have shown promise in constructing mechanistic models from data. However, existing evaluations largely focus on simplified settings and fail to capture…

cs.DL2025★ 1 cited

Expert-Grounded Automatic Prompt Engineering for Extracting Lattice Constants of High-Entropy Alloys from Scientific Publications using Large Language Models

Shunshun Liu, Talon R. Booth, Yangfeng Ji +2

Large language models (LLMs) have shown promise for scientific data extraction from publications, but rely on manual prompt refinement. We present an expert-grounded automatic prom…

cond-mat.supr-con2025

Type-1.5 SNSPD: Interacting vortex theory of two bandgap superconducting single photon detectors

Leif Bauer, Daien He, Sathwik Bharadwaj +3

Photon detectors based on type-2 superconductors have found widespread applications from on-chip quantum computing to quantum remote sensing. Here, we develop the theory for a new…

cond-mat.mtrl-sci2025

Towards "on-demand" van der Waals epitaxy with adaptive ensemble sampling atomistic workflows

Soumendu Bagchi, Ankita Biswas, Prasanna V. Balachandran +2

Traditional approaches to achieve targeted epitaxial growth involves exploring a vast parameter space of thermodynamical and kinetic drivers (e.g., temperature, pressure, chemical…

cond-mat.mtrl-sci2025

High thermoelectric power factor in Ni-Fe alloy for active cooling applications

Shuai Li, Sree Sourav Das, Haobo Wang +5

Metallic thermoelectric materials are promising candidates for active cooling applications, where high thermal conductivity and a high thermoelectric power factor are essential to…

cond-mat.mtrl-sci2023★ 16 cited

Observation of helimagnetism in the candidate ferroelectric CrI

John A. Schneeloch, Shunshun Liu, Prasanna V. Balachandran +2

CrI is a quasi-one dimensional (1D) van der Waals (vdW) system that exhibits helimagnetism that propagates along the ribbons. This was determined from neutron time-of-flight…

cond-mat.mtrl-sci2023★ 6 cited

An Atomically Tailored Chiral Magnet with Small Skyrmions at Room Temperature

Tao Liu, Camelia M. Selcu, Binbin Wang +15

Creating materials that do not exist in nature can lead to breakthroughs in science and technology. Magnetic skyrmions are topological excitations that have attracted great attenti…

cond-mat.mtrl-sci2022★ 29 cited

Integrating Machine Learning with Mechanistic Models for Predicting the Yield Strength of High Entropy Alloys

Shunshun Liu, Kyungtae Lee, Prasanna V. Balachandran

Accelerating the design of materials with targeted properties is one of the key materials informatics tasks. The most common approach takes a data-driven motivation, where the unde…

cond-mat.mes-hall2021★ 25 cited

Tunable Magnetic Skyrmions in Ferrimagnetic MnN

Chung T. Ma, Timothy Q. Hartnett, Wei Zhou +2

Thin films of ferrimagnetic MnN are candidate materials to host magnetic skyrmions that have demonstrated thermal stability up to 450C. However, there are no experiment…

cond-mat.mtrl-sci2021★ 82 cited

Phase Classification of Multi-Principal Element Alloys via Interpretable Machine Learning

Kyungtae Lee, Mukil Ayyasamy, Paige Delsa +2

There is intense interest in uncovering design rules that govern the formation of various structural phases as a function of chemical composition in multi-principal element alloys…

cond-mat.mtrl-sci2021★ 27 cited

Tuning Dzyaloshinskii-Moriya Interaction in Ferrimagnetic GdCo: A First Principles Approach

Md Golam Morshed, Khoong Hong Khoo, Yassine Quessab +5

We present a systematic analysis of our ability to tune chiral Dzyaloshinskii-Moriya Interactions (DMI) in compensated ferrimagnetic Pt/GdCo/Pt1-xWx trilayers by cap layer composit…

cond-mat.mtrl-sci2021★ 99 cited

Computing and Memory Technologies based on Magnetic Skyrmions

Hamed Vakili, Wei Zhou, Chung T Ma +13

Solitonic magnetic excitations such as domain walls and, specifically, skyrmionics enable the possibility of compact, high density, ultrafast,all-electronic, low-energy devices, wh…

cond-mat.mtrl-sci2020★ 17 cited

Rare-earth-free ferrimagnetic Mn4N sub-20 nm thin films as high-temperature spintronic material

W. Zhou, C. T. Ma, T. Q. Hartnett +2

Ferrimagnetic alloy thin films that exhibit perpendicular (out-of-plane) magnetic anisotropy (PMA) with low saturation magnetization, such as GdCo and Mn4N, were predicted to be fa…

cond-mat.mtrl-sci2020★ 29 cited

Magnetic Damping in Epitaxial Fe Alloyed with Vanadium and Aluminum

David A. Smith, Anish Rai, Youngmin Lim +12

To develop low-moment, low-damping metallic ferromagnets for power-efficient spintronic devices, it is crucial to understand how magnetic relaxation is impacted by the addition of…

cond-mat.mtrl-sci2019★ 80 cited

Conductivity-Like Gilbert Damping due to Intraband Scattering in Epitaxial Iron

Behrouz Khodadadi, Anish Rai, Arjun Sapkota +15

Confirming the origin of Gilbert damping by experiment has remained a challenge for many decades, even for simple ferromagnetic metals. In this Letter, we experimentally identify G…

cond-mat.mtrl-sci2013★ 100 cited

Interplay of octahedral rotations and breathing distortions in charge ordering perovskite oxides

Prasanna V. Balachandran, James M. Rondinelli

We investigate the structure--property relationships in O perovskites exhibiting octahedral rotations and cooperative octahedral breathing distortions (CBD) using group the…