Alexey L. Kaledin - Department of Chemistry and Cherry L. Emerson Center for Scientific Computation, Emory University

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论文共 93 篇作者统计合作学者相似作者

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Shell Thickness and Heterogeneity Dependence of Triplet Energy Transfer Between Core-Shell Quantum Dots and Adsorbed Molecules

Tao Jin, Zhendian Zhang, Sheng He,Alexey L Kaledin,Zihao Xu, Yawei Liu,Peng Zhang,David N Beratan, Tianquan Lian

pubmed（2025）

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First-Principles Path Integral Monte Carlo Studies of the Pseudo Jahn-Teller Effect in the Aromatic Cyclo[10]carbon

Anna H James,Martina Kaledin,Alexey L Kaledin

The journal of physical chemistry Ano. 9 (2025): 2238-2246

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Oligoyne Bridges Enable Strong Through-Bond Coupling and Efficient Triplet Transfer from CdSe QD Trap Excitons for Photon Upconversion

Tsumugi Miyashita,Sheng He,Paulina Jaimes,Alexey L. Kaledin,Maria Fumanal,Tianquan Lian,Ming Lee Tang

JOURNAL OF CHEMICAL PHYSICSno. 9 (2024)

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Doping of Colloidal Nanocrystals for Optimizing Interfacial Charge Transfer: A Double-Edged Sword

Sheng He, Anji Ni,Sara T. Gebre, Rui Hang,James R. McBride,Alexey L. Kaledin,Wenxing Yang,Tianquan Lian

Journal of the American Chemical Society (2024)

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Quantum Monte Carlo Simulations of the Vibrational Wavefunction of the Aromatic Cyclo[10]carbon Using a Full Dimensional Permutationally Invariant Potential Energy Surface

Benjamin D. Gibbas,Martina Kaledin,Alexey L. Kaledin

JOURNAL OF PHYSICAL CHEMISTRY LETTERSno. 19 (2024): 5070-5075

引用1浏览0WOS引用

A Low-Order Permutationally Invariant Polynomial Approach to Learning Potential Energy Surfaces Using the Bond-Order Charge-Density Matrix: Application to C N Clusters for N=3-10, 20

Jose Gutierrez-Cardenas, Benjamin D. Gibbas, Kyle Whitaker,Martina Kaledin,Alexey L. Kaledin

JOURNAL OF PHYSICAL CHEMISTRY Ano. 36 (2024): 7703-7713

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Fitting Potential Energy Surfaces by Learning the Charge Density Matrix with Permutationally Invariant Polynomials

Younos Hashem,Katheryn Foust,Martina Kaledin,Alexey L. Kaledin

JOURNAL OF CHEMICAL THEORY AND COMPUTATION（2023）

引用4浏览0WOS引用

Revisiting Then(n + 1)/2‐sites‐type Gaussian Charge Model for Permutationally Invariant Polynomial Fitting of Global Molecular Tensor Surfaces

Sophia A. Kudratov,Martina Kaledin,Alexey L. Kaledin

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRYno. 11 (2023)

引用1浏览0引用

Photo- and Metal-Mediated Deconstructive Approaches to Cyclic Aliphatic Amine Diversification

David M. Soro,Jose B. Roque,Jonas W. Rackl,Bohyun Park,Stefan Payer, Yuan Shi,J. Craig Ruble,Alexey L. Kaledin,Mu-Hyun Baik,Djamaladdin G. Musaev,Richmond Sarpong

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY（2023）

引用15浏览0WOS引用

Permutationally Invariant Polynomial Representation of Polarizability Tensor Surfaces for Linear Regression Analysis

Oluwaseun Omodemi,Martina Kaledin,Alexey L. Kaledin

Journal of Computational Chemistry（2022）

引用5浏览0EIWOS引用

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