Faculty

Institution

Unit

Venue

Nancy Makri

Edward William and Jane Marr Gutgsell Professor in Chemistry

UIUC

Affiliations

College of Liberal Arts & Sciences

Department of Chemistry

School of Chemical Sciences

Department of Chemistry

The Grainger College of Engineering

Department of Physics

Physics

Nancy Makri is currently serving as a College Of Liberal Arts & Sciences Edward William and Jane Marr Gutgsell Professor in Chemistry at Uiuc.

Honors

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Experiences

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Education

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Nancy Makri

UIUC

Edward William and Jane Marr Gutgsell Professor in Chemistry

You can click a keyword to filter the displayed items

physics quantum mechanics applied mathematics quantum dynamics quantum science quantum chemistry applied physics statistical mechanics mathematical physics computational chemistry computational physics physical chemistry dynamical systems statistical physics quantum information science spectral theory theoretical chemistry quantum simulation nonlinear phenomena numerical analysis mathematics chemical physics nonlinear dynamics quantum systems molecular physics monte carlo scientific computing excited state property monte carlo methods excitation energy transfer numerical simulations many-body quantum physics molecular structure vibrational spectroscopy theoretical physics quantum mechanical properties nonlinear science electronic excited states time correlation functions quantum chaos vibronic interaction path integral quantum liquids monte carlo sampling harmonic bath quantum theory quantum biology hamiltonian system nonlinear resonance molecular kinetics quantum algorithms molecular mechanics mathematical statistical physic quantum decoherence disordered quantum system correlation functions classical trajectories forward-backward semiclassical dynamics numerical computation photophysical properties non-equilibrium process hamiltonian theory small matrix decomposition correlation function statistical field theories many-body problem ab-initio methods critical phenomena electronic states influence functional time-dependent quantum mechanics feynman path integration real time forward−backward semiclassical dynamics density matrix molecular aggregates path integral formulation mechanical processes

Notable Scholarly Works

Notable Federal Grants

Collaborators

Discrete Generalized Quantum Master Equations. Journal of Chemical Theory and Computation (2025)

Nancy Makri

quantum optimization algorithmsdiscrete kernelsquantum mechanicsquantum field theorydiscrete memory kernelphysicsquantum information scienceaccurate discretizationmathematicsquantum machine learningquantum engineeringquantum dynamicsquantum sciencespectral theoryapplied mathematics

Quantum Dynamics of Dissipative Two-Level Systems and Intradimer Excitation Energy Transfer in the Presence of Static Disorder. The Journal of Chemical Physics (2025)

Eleanor L. VandelNancy Makri

disordered quantum systemexcited state propertyquantum mechanicsvibrational spectroscopyphysicsquantum chemistrymolecular physicscomputational chemistrylow temperaturesvibronic interactionquantum dynamicsquantum scienceexcitation energy transferstatic disorderapplied physicsvibrational modesdensity functional theory

Coherence in Chemistry: Foundations and Frontiers. Chemical Reviews (2024)

Jonathan D. SchultzJonathon L. YulyEric A. ArsenaultKelsey ParkerSutirtha N. ChowdhuryReshmi DaniSohang KunduHanggai NuominZhendian ZhangJesús ValdiviezoPeng ZhangKaydren OrcuttSeogjoo J. JangGraham R. FlemingNancy MakriJennifer P. OgilvieMichael J. TherienMichael R. WasielewskiDavid N. Beratan

quantum mechanicschemical physicsphilosophy of chemistrycoherence resonancephysicsquantum chemistrycoherence (signal processing)physical chemistrymolecular sciencecoherence referstheoretical chemistrychemistrycoherent processcoherence phenomenaquantum scienceenergy harvestingmolecular physics

Comment on"Unified Framework for Open Quantum Dynamics With Memory". arXiv (Cornell University) (2024)

Makri, NancyKundu, SohangCai, ZhenningWang, Geshuo

lattice field theoryquantum computingquantum mechanicsphysicsquantum information sciencemathematical physicspath integralmathematicssmatpi decompositionharmonic bathquantum dynamicsquantum scienceapplied mathematicsmathematical sciences

Essential vs Removable Bath Anharmonicity: Path Integral Results With Model Electronic-Vibrational Baths. The Journal of Physical Chemistry Letters (2024)

Nancy Makri

quantum mechanicspath integral resultsvibrational spectroscopyphysicsquantum chemistryphysical chemistrybath unitsquantum dynamicsquantum scienceelectronic statesnonlinear resonanceapplied physics

Kink Sum for Long-Memory Small Matrix Path Integral Dynamics. The Journal of Physical Chemistry B (2024)

Nancy Makri

physicscomputational physicsnumerical analysismathematical physicsscientific computingcomputational mathematicskink sumsmall sizenumerical mathematicsmany-body quantum physicssmatpi algorithmnumerical computationnumerical linear algebramatrix theorymatrix methodsspectral theoryapplied mathematicsnumerical algorithms

Parsing the Influence Functional: Harmonic Bath Mapping and Anharmonic Small Matrix Path Integral. The Journal of Physical Chemistry Letters (2024)

Nancy Makri

nonlinear systemsnonlinear analysisphysicsengineeringnumerical analysisharmonic analysisapplied mathematical modellingnumerical mathematicsinfluence functionalnumerical computationnonlinear dynamicsharmonic bath mappingharmonic mappingspectral theoryapplied mathematicsdynamical systems

Path Integral Over Equivalence Classes for Quantum Dynamics With Static Disorder. The Journal of Physical Chemistry Letters (2024)

Nancy Makri

disordered quantum systemequivalence classesquantum mechanicsphysicsmathematical physicspath integralmathematicsquantum dynamicsquantum sciencestatic disorderspectral theoryapplied mathematicsdynamical systems

Quantum Information Scrambling and Chemical Reactions. Proceedings of the National Academy of Sciences (2024)

Chenghao ZhangSohang KunduNancy MakriMartin GruebelePeter G. Wolynes

nonlinear phenomenachemical reaction dynamicsquantum mechanicschaos theorynonlinear sciencequantum chaosphysicsquantum information sciencechemical reactionsquantum dynamicsquantum sciencenonlinear dynamicsapplied mathematicsdynamical systems

Roadmap on Methods and Software for Electronic Structure Based Simulations in Chemistry and Materials. Electronic Structure (2024)

Volker BlumRyoji AsahiJochen AutschbachChristoph BannwarthGustav BihlmayerStefan BlügelLori A BurnsT Daniel CrawfordWilliam DawsonWibe Albert de JongClaudia DraxlClaudia FilippiLuigi GenovesePaolo GiannozziNiranjan GovindSharon Hammes-SchifferJeff R HammondBenjamin HourahineAnubhav JainYosuke KanaiPaul R C KentAsk Hjorth LarsenSusi LehtolaXiaosong LiRoland LindhSatoshi MaedaNancy MakriJonathan MoussaTakahito NakajimaJessica A NashMicael J T OliveiraPansy D PatelGiovanni PizziGeoffrey PourtoisBenjamin P PritchardEran RabaniMarkus ReiherLucia ReiningXinguo RenMariana RossiH Bernhard SchlegelNicola SerianiLyudmila V SlipchenkoAlexander ThomEdward F ValeevBenoit Van TroeyeLucas VisscherVojtěch VlčekHans-Joachim WernerDavid B Williams-YoungTheresa L. Windus

roadmap articlechemical physicsphysicsmolecular modellingcomputational materials sciencequantum chemistrycomputational chemistrymolecular sciencemolecular structureab-initio methodsmaterial simulationelectronic structurees softwarechemistryapplied physicsdensity functional theory

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Nancy Makri

Edward William and Jane Marr Gutgsell Professor in Chemistry

UIUC

Affiliations

College of Liberal Arts & Sciences

Department of Chemistry

School of Chemical Sciences

Department of Chemistry

The Grainger College of Engineering

Department of Physics

Physics

Nancy Makri is currently serving as a College Of Liberal Arts & Sciences Edward William and Jane Marr Gutgsell Professor in Chemistry at Uiuc.

Honors

Create free account to unlock more features

Experiences

Create free account to unlock more features

Education

Create free account to unlock more features

Nancy Makri

UIUC

Edward William and Jane Marr Gutgsell Professor in Chemistry

You can click a keyword to filter the displayed items

Notable Scholarly Works

Notable Federal Grants

Collaborators

Discrete Generalized Quantum Master Equations. Journal of Chemical Theory and Computation (2025)

Nancy Makri

Quantum Dynamics of Dissipative Two-Level Systems and Intradimer Excitation Energy Transfer in the Presence of Static Disorder. The Journal of Chemical Physics (2025)

Eleanor L. VandelNancy Makri

Coherence in Chemistry: Foundations and Frontiers. Chemical Reviews (2024)

Comment on"Unified Framework for Open Quantum Dynamics With Memory". arXiv (Cornell University) (2024)

Makri, NancyKundu, SohangCai, ZhenningWang, Geshuo

Essential vs Removable Bath Anharmonicity: Path Integral Results With Model Electronic-Vibrational Baths. The Journal of Physical Chemistry Letters (2024)

Nancy Makri

quantum mechanicspath integral resultsvibrational spectroscopyphysicsquantum chemistryphysical chemistrybath unitsquantum dynamicsquantum scienceelectronic statesnonlinear resonanceapplied physics

Kink Sum for Long-Memory Small Matrix Path Integral Dynamics. The Journal of Physical Chemistry B (2024)

Nancy Makri

Parsing the Influence Functional: Harmonic Bath Mapping and Anharmonic Small Matrix Path Integral. The Journal of Physical Chemistry Letters (2024)

Nancy Makri

Path Integral Over Equivalence Classes for Quantum Dynamics With Static Disorder. The Journal of Physical Chemistry Letters (2024)

Nancy Makri

Quantum Information Scrambling and Chemical Reactions. Proceedings of the National Academy of Sciences (2024)

Chenghao ZhangSohang KunduNancy MakriMartin GruebelePeter G. Wolynes

Roadmap on Methods and Software for Electronic Structure Based Simulations in Chemistry and Materials. Electronic Structure (2024)

1
2
3
4
5
19
10 / page