Faculty

Institution

Unit

Venue

Mark Hoffmann

Professor Associate Dean for Research

University of North Dakota

Affiliations

College of Arts & Sciences

Math & Science

Department of Chemistry

Mark Hoffmann is currently serving as a College Of Arts & Sciences Professor Associate Dean for Research at University of North Dakota.

Honors

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Experiences

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Education

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Mark Hoffmann

University of North Dakota

Professor Associate Dean for Research

You can click a keyword to filter the displayed items

physical chemistry quantum chemistry theoretical chemistry materials science chemistry physics computational chemistry theoretical study biophysics condensed matter physics inorganic chemistry atomic physics density functional theory molecular structure low-lying electronic states coordination chemistry transition metal chemistry mathematical chemistry multireference perturbation theory scientific computing laser science excited states external orbital orthogonality electronic states physical organic chemistry quantum science proton transfer theoretical inorganic chemistry excited state property gpu computing ab-initio methods main group chemistry intermolecular hydrogen bonding molecular electronic structure electron correlation quasidegenerate perturbation theory large eigenvalue problems intense radiation field human-computer interaction manufacturing technology free radical biology redox biology chemical sciences material chemistry clay science condensed matter electronic materials inorganic chemistry frontier independent component analysis quantum algorithms electronic structure coordination complex mitochondrial function perturbation methods lagrangian method astrochemistry solid-state chemistry finite element methods gpu architecture gpu virtualization numerical computation memory architectures lithium-ion batteries parallel implementation molecular fragmentation layered materials radical (chemistry) nanosensors anion sensing cation sensing chemical sensors many-body problem dual fluorescence methyl salicylate iterative ci strong magnetic fields quantum computing molecular computing high performance computing molecular electronics applied physics

Notable Scholarly Works

Notable Federal Grants

Collaborators

A Theoretical Investigation of the Selectivity of Aza-Crown Ether Structures Chelating Alkali Metal Cations for Potential Biosensing Applications. Molecules (2025)

biosensorstheoretical investigationchemical engineeringcation sensingpotential biosensing applicationschemical sensorsinorganic chemistry frontiernanosensorsanalytical chemistryelectroanalytical chemistrychemistryinorganic chemistrychemical structureanion sensing

In‐Medium Similarity Renormalization Group Approach for Closed‐Shell Atoms. Journal of Computational Chemistry (2025)

physicscomputational chemistrychemical physicsclosed‐shell atomsatomic physicsmolecular modellingquantum chemistrymany-body problemdensity functional theoryab-initio methodsapplied physicsmolecular physicscomputational physicstheoretical chemistry

Biomechanically Tunable Scaffolds for Bone Tissue Regeneration and Testbeds of Cancer Bone Metastasis. Materialia (2024)

Krishna KunduHanmant K. GaikwadSharad V. JaswandkarPreetham RaviParth VyasMark R. HoffmannDeniz CakirDinesh R. KattiKalpana S. Katti

materials sciencetunable scaffoldscancer bone metastasisregenerative medicinebone tissue regeneration

Perspective on the Role of Quantum Mechanical Calculations on Cellular Molecular Interactions. Frontiers in computational chemistry (2024)

Mouhmad ElayyanBinglin SuiMark R. Hoffmann

cellular molecular interactionsmolecular biologycomputational chemistryquantum mechanical calculations

Physics-Informed Neural Networks for Quantum Wavefunctions. (2024)

physicsquantum sciencequantum mechanicsphysics-informed neural networksquantum machine learningneural network (machine learning)quantum information science

Potential-Energy Curves for the Ground and Several Electronic States of Ndo and Nds. The Journal of Physical Chemistry A (2024)

Aliakbar SepehriAlexandar AzenkengMark R. Hoffmann

physicsphysical chemistryquantum chemistrypotential-energy curves

Exploring the Biointerfaces: Ab Initio Investigation of Nano-Montmorillonite Clay, and Its Interaction With Unnatural Amino Acids. Physical Chemistry Chemical Physics (2023)

Ashan FernandoDesmond KhanMark R. HoffmannDeniz Çakır

physicsmaterials sciencebiophysicsclay sciencephysical chemistryunnatural amino acidsnano-montmorillonite claynanotechnology

Riemannian Trust Region Method for Minimization of the Fourth Central Moment for Localized Molecular Orbitals. The Journal of Physical Chemistry A (2023)

Aliakbar SepehriRun R. LiMark R. Hoffmann

physicsbiophysicscomputational chemistryphysical chemistryquantum chemistryfourth central momentlocalized molecular orbitalsapplied physicstheoretical chemistry

Further Development of Icipt2 for Strongly Correlated Electrons. Journal of Chemical Theory and Computation (2021)

Ning ZhangWenjian LiuMark R. Hoffmann

physical chemistrycomputational chemistrychemistryquantum chemistry

Low-Lying Electronic States of the Nickel Dimer. Frontiers in Chemistry (2021)

Patrick K. TamukongMark R. Hoffmann

atomic physicsnickel dimerlow-lying electronic stateschemistry

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Mark Hoffmann

Professor Associate Dean for Research

University of North Dakota

Affiliations

College of Arts & Sciences

Math & Science

Department of Chemistry

Mark Hoffmann is currently serving as a College Of Arts & Sciences Professor Associate Dean for Research at University of North Dakota.

Honors

Create free account to unlock more features

Experiences

Create free account to unlock more features

Education

Create free account to unlock more features

Mark Hoffmann

University of North Dakota

Professor Associate Dean for Research

You can click a keyword to filter the displayed items

Notable Scholarly Works

Notable Federal Grants

Collaborators

A Theoretical Investigation of the Selectivity of Aza-Crown Ether Structures Chelating Alkali Metal Cations for Potential Biosensing Applications. Molecules (2025)

In‐Medium Similarity Renormalization Group Approach for Closed‐Shell Atoms. Journal of Computational Chemistry (2025)

Biomechanically Tunable Scaffolds for Bone Tissue Regeneration and Testbeds of Cancer Bone Metastasis. Materialia (2024)

Krishna KunduHanmant K. GaikwadSharad V. JaswandkarPreetham RaviParth VyasMark R. HoffmannDeniz CakirDinesh R. KattiKalpana S. Katti

materials sciencetunable scaffoldscancer bone metastasisregenerative medicinebone tissue regeneration

Perspective on the Role of Quantum Mechanical Calculations on Cellular Molecular Interactions. Frontiers in computational chemistry (2024)

Mouhmad ElayyanBinglin SuiMark R. Hoffmann

cellular molecular interactionsmolecular biologycomputational chemistryquantum mechanical calculations

Physics-Informed Neural Networks for Quantum Wavefunctions. (2024)

physicsquantum sciencequantum mechanicsphysics-informed neural networksquantum machine learningneural network (machine learning)quantum information science

Potential-Energy Curves for the Ground and Several Electronic States of Ndo and Nds. The Journal of Physical Chemistry A (2024)

Aliakbar SepehriAlexandar AzenkengMark R. Hoffmann

physicsphysical chemistryquantum chemistrypotential-energy curves

Exploring the Biointerfaces: Ab Initio Investigation of Nano-Montmorillonite Clay, and Its Interaction With Unnatural Amino Acids. Physical Chemistry Chemical Physics (2023)

Ashan FernandoDesmond KhanMark R. HoffmannDeniz Çakır

physicsmaterials sciencebiophysicsclay sciencephysical chemistryunnatural amino acidsnano-montmorillonite claynanotechnology

Riemannian Trust Region Method for Minimization of the Fourth Central Moment for Localized Molecular Orbitals. The Journal of Physical Chemistry A (2023)

Aliakbar SepehriRun R. LiMark R. Hoffmann

physicsbiophysicscomputational chemistryphysical chemistryquantum chemistryfourth central momentlocalized molecular orbitalsapplied physicstheoretical chemistry

Further Development of Icipt2 for Strongly Correlated Electrons. Journal of Chemical Theory and Computation (2021)

Ning ZhangWenjian LiuMark R. Hoffmann

physical chemistrycomputational chemistrychemistryquantum chemistry

Low-Lying Electronic States of the Nickel Dimer. Frontiers in Chemistry (2021)

Patrick K. TamukongMark R. Hoffmann

atomic physicsnickel dimerlow-lying electronic stateschemistry

1
2
3
4
5
13
10 / page

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