Journal
APS March Meeting Abstracts
Published here
82 counted works of 91 linked
| Year | Title | Academics | Sources |
|---|---|---|---|
| 2024 | An Expressway towards Heaven: High-Throughput Hybrid Density Functional Theory for Complex Condensed-Phase Systems Containing Thousands of Atoms using SeA | Robert A. DiStasio Jr. | GS |
| 2024 | Characterizing Rotational Dynamics in Glassy Systems from Single Molecule Intensity Fluctuations | Laura J. Kaufman | GS |
| 2024 | Controlling cell position in heterotypic spheroids: an experimental and computational demonstration | Laura J. Kaufman | GS |
| 2024 | Detecting Band Inversions in Topological Insulators with Diffusion Monte Carlo | Brenda Rubenstein | GS |
| 2024 | Dipolar interaction in an array of individually-controlled molecules | Kang-Kuen Ni | GS |
| 2024 | Direct visualization of hybridized excitons in twisted WS2/MoSe 2 heterobilayers | Alice Kunin | GS |
| 2024 | Dynamic Heterogeneity in Plasticized Polystyrene Thin Films | Laura J. Kaufman | GS |
| 2024 | Emergent excitons in super-twisted spiral transition metal dichalcogenide | Yusong Bai | GS |
| 2024 | Estimating Thermally Driven Magnetic Field Fluctuations near Nanoscale Ferromagnets-Understanding Signal Loss in Magnetic Resonance Force Microscopy (MRFM) | John A. Marohn | GS |
| 2024 | Fluidization of jammed epithelia by noninvasive carcinoma in a heterogeneous tumor model | Laura J. Kaufman | GS |
| 2024 | Harnessing chemical reactions for quantum science | Kang-Kuen Ni | GS |
| 2024 | Machine learning molecular conformational energies using semi-local density fingerprints | Robert A. DiStasio Jr. | GS |
| 2024 | Molecular dynamics simulations of polyethylene inter-crystalline phase formation | Wenlin Zhang | GS |
| 2024 | Molecular Dynamics Study of the Interactions between Polyethylene Nanoplastic Particles and Lipid Membranes | Wenlin Zhang | GS |
| 2024 | NISQ Computing the Climate | Brenda Rubenstein | GS |
| 2024 | Oral: Elucidating the Role of Dimensionality on the Electronic Structure of the van-der-Waals Antiferromagnet NiPS3 related record | Brenda Rubenstein | GS |
| 2024 | Polaronic electron crystals and nano-acoustics in van der Waals heterostructures | Eric Arsenault | GS |
| 2024 | Probing the Viscoelastic Properties of Stable Glass Surfaces | Zahra Fakhraai | GS |
| 2024 | Signatures of Jamming in a Potts Model of Cellular Migration | Laura J. Kaufman | GS |
| 2024 | The minimum and optimal restraints in FRET-assisted protein structural modeling | Caitlin Davis | GS |
| 2024 | Three-dimensional atomic structure of amorphous solids | Ou Chen | GS |
| 2024 | Towards controlling local excitons with chiral edge states in the terraced bilayer 1T'-WTe2/CrI3 | Brenda Rubenstein | GS |
| 2024 | Uniting non-empirical and empirical density functional approximation strategies with the constrained and smoothed empirical (CASE) framework | Robert A. DiStasio Jr. | GS |
| 2023 | Accurate electronic ground- and excited-state properties of 2D CrI3 and its heterostructures | Brenda Rubenstein | GS |
| 2023 | Atomistic simulations and theory of composition-dependent crystal nucleation in polymer blends | Wenlin Zhang | GS |
| 2023 | Auxiliary-Field Quantum Monte Carlo for Calculating the Renyi and Accessible Entanglement Entropies | Brenda Rubenstein | GS |
| 2023 | Formation of stable glasses on soft substrates | Zahra Fakhraai | GS |
| 2023 | Hybridized Excitons in WS2/MoSe2 Heterobilayers Visualized by Time- and Angle-Resolved Photoemission Spectroscopy | Alice Kunin | GS |
| 2023 | Monitoring the Kinetic stability of vapor-deposited glasses using in-situ solvent vapor annealing. | Zahra Fakhraai | GS |
| 2023 | Reactive Bottom-up Coarse-Grained Model for Hydrated Protons | Jaehyeok Jin | GS |
| 2023 | Statistical Mechanical Paradigms for Next-Generation Coarse-Grained Modeling | Jaehyeok Jin | GS |
| 2023 | Statistics of Classical Nonlinear Dynamical Systems Obtained from Noisy Intermediate-Scale Quantum Devices | Brenda Rubenstein | GS |
| 2023 | Strong Correlated States in WSe2/WS2 Moiré Superlattices | Yusong Bai | GS |
| 2023 | Strong Coupling, Disordered Environments, and Chemistry Under Illumination | Joseph Subotnik | GS |
| 2023 | Surface Mediated Formation of Stable Glasses | Zahra Fakhraai | GS |
| 2023 | VMC with ultra-compact, explicitly-correlated wave functions for the study of the Li isoelectronic sequence | Brenda Rubenstein | GS |
| 2022 | A Combined First Principles Study of the Structural, Magnetic, and Phonon Properties of Monolayer CrI3 related record | Brenda Rubenstein | GS |
| 2022 | A New Direction of Polymer Nanocomposite: Polymer Infiltrated Scaffold Metals | Zahra Fakhraai | GS |
| 2022 | Anisotropic Carrier Dynamics in Graphite/Graphene Probed with Time-and Angle-Resolved Photoemission Spectroscopy | Alice Kunin | GS |
| 2022 | Biopolymer self-assembly and aggregation at interfaces | Zahra Fakhraai | GS |
| 2022 | Chemically decomposed elastic properties from first principles: The elastic anomaly in PbTiO3 | Robert A. DiStasio Jr. | GS |
| 2022 | Correlated States in Bilayer WSe2/WS2 Moiré Heterostructures | Yusong Bai | GS |
| 2022 | Extending the Reach of Quantum Monte Carlo Methods via Machine Learning | Brenda Rubenstein | GS |
| 2022 | Fueling a Data-Driven Machine Learning Model for H3O+ and OH- Transport through Confined Aqueous Environments: A High-Throughput Order-N Framework … | Robert A. DiStasio Jr. | GS |
| 2022 | In-situ ellipsometry characterization of vapor-deposited stable molecular glasses | Zahra Fakhraai | GS |
| 2022 | Layer-by-layer crystallization from surface-induced nematic layers: a new mechanism of secondary nucleation revealed by molecular dynamic simulations | Wenlin Zhang | GS |
| 2022 | Quinary structure modulates protein sequence stability in vivo | Caitlin Davis | GS |
| 2022 | Range-Separated Hybrid Functional Pseudopotentials | Robert A. DiStasio Jr. | GS |
| 2022 | Semi-Local Density Fingerprints for Machine Learning Molecular Properties, Intra-/Inter-molecular Interactions, and Chemical Reactions | Robert A. DiStasio Jr. | GS |
| 2022 | Spin Manipulation through A Molecular Junction Based on Nuclear Berry Curvature Effect | Joseph Subotnik | GS |
| 2022 | Studying the kinetic stability of molecular glasses using solvent vapor annealing | Zahra Fakhraai | GS |
| 2022 | Thermal and UV stability of organic glasses under extreme nanoconfinement | Zahra Fakhraai | GS |
| 2022 | Thin Film Rheology via Focused Laser Spike Thermocapillary Dewetting | Zahra Fakhraai | GS |
| 2022 | Towards a Realistic Description of H3O+ and OH- Transport through Confined Environments using Machine Learning and an Order-N Framework for Condensed … | Robert A. DiStasio Jr. | GS |
| 2022 | Unbiasing Fermionic Quantum Monte Carlo with a Quantum Computer related record | Joonho Lee | GS |
| 2022 | Understanding the roles of molecular topology and entanglement in polymer crystallization using ring polymers | Wenlin Zhang | GS |
| 2021 | Effects of phase separation and interfaces on incompatible polymer crystallization | Wenlin Zhang | GS |
| 2021 | Improved Mechanical Properties of Organic Stable Glasses by Nanoindentation | Zahra Fakhraai | GS |
| 2021 | Polymer Infiltrated Nanoporous Metals: A New Class of Composite Material | Zahra Fakhraai | GS |
| 2019 | Ab Initio Finite Temperature Auxiliary Field Quantum Monte Carlo for Solids | Brenda Rubenstein | GS |
| 2019 | An Auxiliary Field Quantum Monte Carlo study of the Hubbard Kanamori model related record | Brenda Rubenstein | GS |
| 2019 | Nonadiabatic dynamics at metal surfaces: Surface hopping and electronic friction | Joseph Subotnik | GS |
| 2019 | Revisiting Glassy Behavior in Polystyrene with Single Molecule Approaches | Laura J. Kaufman | GS |
| 2019 | Tension-induced nematic phase separation in homopolymer melts | Wenlin Zhang | GS |
| 2019 | Trapped Ion Heating from Correlated Motion of Electrode Adsorbates | Brenda Rubenstein | GS |
| 2018 | A case for active self-assembly: The Kagome lattice | Angelo Cacciuto | GS |
| 2018 | A unified Lagrangian treatment of charge and cantilever dynamics in electric force microscopy | John A. Marohn | GS |
| 2018 | Open challenges in nonadiabatic dynamics: photons and electron-hole pairs | Joseph Subotnik | GS |
| 2018 | Surface Fluctuation of Colloids Dominates Fragility | Angelo Cacciuto | GS |
| 2017 | Direct Observation of Electron-Phonon Coupling and Slow Vibrational Relaxation in Organic-Inorganic Hybrid Perovskites related record | Joseph Subotnik | GS |
| 2017 | Effects of chain stiffness on the performance of conjugated polymers | Wenlin Zhang | GS |
| 2017 | Non-Covalent Interactions and Thermal Effects in the Quest for Selective Atomic Layer Deposition | Robert A. DiStasio Jr. | GS |
| 2017 | Why does hydronium diffuse much faster than hydroxide in liquid water? related record | Robert A. DiStasio Jr. | GS |
| 2016 | Fragility-Controllable Polymer Grafted Nanoparticles | Angelo Cacciuto | GS |
| 2016 | Large-Scale Hybrid Density Functional Theory Calculations in the Condensed-Phase: Ab Initio Molecular Dynamics in the Isobaric-Isothermal Ensemble | Robert A. DiStasio Jr. | GS |
| 2016 | Local Structure in Ab Initio Liquid Water: Signatures of Amorphous Phases | Robert A. DiStasio Jr. | GS |
| 2016 | Photoexcited Nuclear Dynamics with Ab Initio Electronic Structure Theory: Is TD-DFT Ready For the Challenge? | Joseph Subotnik | GS |
| 2016 | Predicting χ for polymers with stiffness mismatch from simulations | Wenlin Zhang | GS |
| 2016 | Surface induced alignment for semiflexible polymers related record | Wenlin Zhang | GS |
| 2016 | The Dipole Polarizability of a Water Molecule in Liquid Water | Robert A. DiStasio Jr. | GS |
| 2016 | The Role of Anharmonicity and Nuclear Quantum Effects in the Pyridine Molecular Crystal: An ab initio Molecular Dynamics Study | Robert A. DiStasio Jr. | GS |
| 2015 | Many-Body Dispersion Interactions in Molecular Materials | Robert A. DiStasio Jr. | GS |
| 2015 | Predicting nematic coupling constants of semiflexible polymers from MD simulations | Wenlin Zhang | GS |
| 2015 | Probing Ultrafast Chemical Dynamics with X-ray Absorption Spectroscopy | Christoph Rose-Petruck | GS |
| 2014 | Nuclear quantum effects in liquid water: A highly accurate ab initio path-integral molecular dynamics study | Robert A. DiStasio Jr. | GS |
| 2014 | Templated Co-assembly of PS-b-PDMS Block Copolymer and Inorganic Nanoparticles | Ou Chen | GS |
| 2014 | The Structure, Density, and Local Environment Distribution in Ab Initio Liquid Water related record | Robert A. DiStasio Jr. | GS |
| 2014 | Van der Waals Interactions in Pyridine and Pyridine-like Molecular Crystals: An ab initio Molecular Dynamics Study related record | Robert A. DiStasio Jr. | GS |
| 2013 | Reconstructing kinetic pathways from single-molecule FRET experiments using Bayesian inference | Ruben L Gonzalez Jr | GS |
| 2012 | ESR induced anomalous polarization in Magnetic Resonance Force Microscopy | John A. Marohn | GS |
| 2003 | Probing the Local Magnetic Structure of Giant Magnetoresistance Devices | Kang-Kuen Ni | GS |