Arindam Chakraborty, Ph.D. - Publications

Affiliations: 
2005 University of Minnesota, Twin Cities, Minneapolis, MN 
Area:
Theoretical and Computational Chemistry

31 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2018 Scher JA, Bayne MG, Srihari A, Nangia S, Chakraborty A. Development of effective stochastic potential method using random matrix theory for efficient conformational sampling of semiconductor nanoparticles at non-zero temperatures. The Journal of Chemical Physics. 149: 014103. PMID 29981557 DOI: 10.1063/1.5026027  0.92
2018 Bayne MG, Scher JA, Ellis BH, Chakraborty A. Linked-cluster formulation of electron-hole interaction kernel in real-space representation without using unoccupied states. Journal of Chemical Theory and Computation. PMID 29782165 DOI: 10.1021/acs.jctc.8b00123  0.56
2016 Chakraborty A, Adhikari P, Shenoy S, Rao S, Dhanashree B, Saralaya V. Molecular characterization and clinical significance of Extraintestinal pathogenic E. coli recovered from a south Indian Tertiary Care Hospital. Microbial Pathogenesis. PMID 26972992 DOI: 10.1016/j.micpath.2016.03.001  1
2015 Ellis BH, Aggarwal S, Chakraborty A. Development of the multicomponent coupled-cluster theory for investigation of multiexcitonic interactions. Journal of Chemical Theory and Computation. PMID 26653409 DOI: 10.1021/acs.jctc.5b00879  1
2015 Elward JM, Chakraborty A. Effect of Heterojunction on Exciton Binding Energy and Electron-Hole Recombination Probability in CdSe/ZnS Quantum Dots. Journal of Chemical Theory and Computation. 11: 462-471. PMID 26580906 DOI: 10.1021/ct500548x  1
2015 Sarkar S, Chakraborty A, Sengupta M, Ghosh S, Mukhopadhyay S, SenGupta M. In vitro activity of levofloxacin against lower respiratory tract pathogens. Journal of Basic and Clinical Pharmacy. 6: 89-93. PMID 26229345 DOI: 10.4103/0976-0105.160749  0.36
2015 Srivastava R, Bhattacharya S, Chakraborty A, Chattopadhyay A. Differential in vivo genotoxicity of arsenic trioxide in glutathione depleted mouse bone marrow cells: expressions of Nrf2/Keap1/P62. Toxicology Mechanisms and Methods. 25: 223-8. PMID 25906049 DOI: 10.3109/15376516.2015.1034334  0.36
2015 Ghosh C, Banik GD, Maity A, Som S, Chakraborty A, Selvan C, Ghosh S, Chowdhury S, Pradhan M. Oxygen-18 isotope of breath CO₂ linking to erythrocytes carbonic anhydrase activity: a biomarker for pre-diabetes and type 2 diabetes. Scientific Reports. 5: 8137. PMID 25633556 DOI: 10.1038/srep08137  0.32
2015 Ghosh S, Adhikary A, Chakraborty S, Bhattacharjee P, Mazumder M, Putatunda S, Gorain M, Chakraborty A, Kundu GC, Das T, Sen PC. Cross-talk between endoplasmic reticulum (ER) stress and the MEK/ERK pathway potentiates apoptosis in human triple negative breast carcinoma cells: role of a dihydropyrimidone, nifetepimine. The Journal of Biological Chemistry. 290: 3936-49. PMID 25527500 DOI: 10.1074/jbc.M114.594028  0.36
2015 Dinara SM, Jana SK, Ghosh S, Mukhopadhyay P, Kumar R, Chakraborty A, Bhattacharya S, Biswas D. Enhancement of two dimensional electron gas concentrations due to Si3N4 passivation on Al0.3Ga0.7N/GaN heterostructure: Strain and interface capacitance analysis Aip Advances. 5. DOI: 10.1063/1.4919098  0.36
2015 Chakraborty A, Biswas D. Comparison of trap characteristics between AlGaN/GaN and AlGaN/InGaN/GaN heterostructure by frequency dependent conductance measurement Applied Physics Letters. 106. DOI: 10.1063/1.4913916  0.36
2015 Elward JM, Chakraborty A. Effect of heterojunction on exciton binding energy and electron-hole recombination probability in CdSe/ZnS quantum dots Journal of Chemical Theory and Computation. 11: 462-471. DOI: 10.1021/ct500548x  1
2015 Bag A, Kumar R, Mukhopadhyay P, Mahata MK, Chakraborty A, Ghosh S, Jana SK, Biswas D. Evolution and analysis of nitride surface and interfaces by statistical techniques: A correlation with RHEED through kinetic roughening Electronic Materials Letters. 11: 707-716. DOI: 10.1007/s13391-015-5129-3  0.36
2014 Elward JM, Irudayanathan FJ, Nangia S, Chakraborty A. Optical Signature of Formation of Protein Corona in the Firefly Luciferase-CdSe Quantum Dot Complex. Journal of Chemical Theory and Computation. 10: 5224-8. PMID 26583205 DOI: 10.1021/ct500681m  1
2013 Elward JM, Chakraborty A. Effect of Dot Size on Exciton Binding Energy and Electron-Hole Recombination Probability in CdSe Quantum Dots. Journal of Chemical Theory and Computation. 9: 4351-9. PMID 26589152 DOI: 10.1021/ct400485s  1
2013 Mielke SL, Chakraborty A, Truhlar DG. Vibrational configuration interaction using a tiered multimode scheme and tests of approximate treatments of vibrational angular momentum coupling: a case study for methane. The Journal of Physical Chemistry. A. 117: 7327-43. PMID 23565728 DOI: 10.1021/jp4011789  1
2013 Blanton CJ, Brenon C, Chakraborty A. Development of polaron-transformed explicitly correlated full configuration interaction method for investigation of quantum-confined Stark effect in GaAs quantum dots. The Journal of Chemical Physics. 138: 054114. PMID 23406105 DOI: 10.1063/1.4789540  1
2012 Elward JM, Thallinger B, Chakraborty A. Calculation of electron-hole recombination probability using explicitly correlated Hartree-Fock method. The Journal of Chemical Physics. 136: 124105. PMID 22462833 DOI: 10.1063/1.3693765  1
2009 Chakraborty A, Pak MV, Hammes-Schiffer S. Properties of the exact universal functional in multicomponent density functional theory. The Journal of Chemical Physics. 131: 124115. PMID 19791860 DOI: 10.1063/1.3236844  1
2009 Pak MV, Chakraborty A, Hammes-Schiffer S. Calculation of the positron annihilation rate in PsH with the positronic extension of the explicitly correlated nuclear-electronic orbital method. The Journal of Physical Chemistry. A. 113: 4004-8. PMID 19281179 DOI: 10.1021/jp810410y  1
2008 Chakraborty A, Hammes-Schiffer S. Density matrix formulation of the nuclear-electronic orbital approach with explicit electron-proton correlation. The Journal of Chemical Physics. 129: 204101. PMID 19045846 DOI: 10.1063/1.2998312  1
2008 Chakraborty A, Pak MV, Hammes-Schiffer S. Development of electron-proton density functionals for multicomponent density functional theory. Physical Review Letters. 101: 153001. PMID 18999594 DOI: 10.1103/PhysRevLett.101.153001  1
2008 Chakraborty A, Pak MV, Hammes-Schiffer S. Inclusion of explicit electron-proton correlation in the nuclear-electronic orbital approach using Gaussian-type geminal functions. The Journal of Chemical Physics. 129: 014101. PMID 18624464 DOI: 10.1063/1.2943144  1
2007 Pak MV, Chakraborty A, Hammes-Schiffer S. Density functional theory treatment of electron correlation in the nuclear-electronic orbital approach. The Journal of Physical Chemistry. A. 111: 4522-6. PMID 17441701 DOI: 10.1021/jp0704463  1
2007 Swalina C, Wang Q, Chakraborty A, Hammes-Schiffer S. Analysis of nuclear quantum effects on hydrogen bonding. The Journal of Physical Chemistry. A. 111: 2206-12. PMID 17388289 DOI: 10.1021/jp0682661  1
2006 Swalina C, Pak MV, Chakraborty A, Hammes-Schiffer S. Explicit dynamical electron-proton correlation in the nuclear-electronic orbital framework. The Journal of Physical Chemistry. A. 110: 9983-7. PMID 16913669 DOI: 10.1021/jp0634297  1
2006 Chakraborty A, Truhlar DG. Converged vibrational energy levels and quantum mechanical vibrational partition function of ethane. The Journal of Chemical Physics. 124: 184310. PMID 16709109 DOI: 10.1063/1.2193521  1
2006 Chakraborty A, Zhao Y, Lin H, Truhlar DG. Combined valence bond-molecular mechanics potential-energy surface and direct dynamics study of rate constants and kinetic isotope effects for the H + C2H6 reaction. The Journal of Chemical Physics. 124: 044315. PMID 16460170 DOI: 10.1063/1.2132276  1
2005 Chakraborty A, Truhlar DG. Quantum mechanical reaction rate constants by vibrational configuration interaction: the OH + H2->H2O + H reaction as a function of temperature. Proceedings of the National Academy of Sciences of the United States of America. 102: 6744-9. PMID 15774583 DOI: 10.1073/pnas.0408048102  1
2004 Wu A, Mukhopadhyay P, Chakraborty A, Fettinger JC, Isaacs L. Molecular clips form isostructural dimeric aggregates from benzene to water. Journal of the American Chemical Society. 126: 10035-43. PMID 15303878 DOI: 10.1021/ja0486972  0.36
2004 Chakraborty A, Truhlar DG, Bowman JM, Carter S. Calculation of converged rovibrational energies and partition function for methane using vibrational-rotational configuration interaction. The Journal of Chemical Physics. 121: 2071-84. PMID 15260761 DOI: 10.1063/1.1759627  1
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