Institution · Parallel Quantum Solutions (United States)
Most cited papers from Parallel Quantum Solutions (United States)
What are the most cited papers from Parallel Quantum Solutions (United States)?
The most cited paper from Parallel Quantum Solutions (United States) is "High-speed colour-converting photodetector with all-inorganic CsPbBr3 perovskite nanocrystals for ultraviolet light communication" (Chun Hong Kang, İbrahim Dursun, Guangyu Liu et al., 2019), with 329 citations. Next come "A multimode analysis of the gas-phase photoelectron spectra in oligoacenes" (174) and "Quantum chemistry in parallel with PQS" (111).
Showing 50 of 70 papers. Every paper is listed.
| # | Paper | ||
|---|---|---|---|
| 1 | High-speed colour-converting photodetector with all-inorganic CsPbBr3 perovskite nanocrystals for ultraviolet light communication Chun Hong Kang, İbrahim Dursun, Guangyu Liu et al. · Light Science & Applications | 16 Oct 2019 | 329 |
| 2 | A multimode analysis of the gas-phase photoelectron spectra in oligoacenes M. Malagoli, Veaceslav Coropceanu, Demétrio A. da Silva Filho et al. · The Journal of Chemical Physics | 2 Apr 2004 | 174 |
| 3 | Quantum chemistry in parallel with PQS Jon Baker, Krzysztof Woliński, Massimo Malagoli et al. · Journal of Computational Chemistry | 9 Jul 2008 | 111 |
| 4 | Second-order Møller–Plesset calculations with dual basis sets Krzysztof Woliński, Péter Pulay · The Journal of Chemical Physics | 15 May 2003 | 106 |
| 5 | A Reliable and Efficient First Principles-Based Method for Predicting pKa Values. 2. Organic Acids Shu-Ming Zhang, Jon Baker, Péter Pulay · The Journal of Physical Chemistry A | 4 Dec 2009 | 105 |
| 6 | Theoretical predictions of enforced structural changes in molecules Krzysztof Woliński, Jon Baker · Molecular Physics | 13 Oct 2009 | 95 |
| 7 | A Reliable and Efficient First Principles-Based Method for Predicting pKaValues. 1. Methodology Shu-Ming Zhang, Jon Baker, Péter Pulay · The Journal of Physical Chemistry A | 4 Dec 2009 | 80 |
| 8 | Towards the Development of Digital Twins for the Bio-manufacturing Industry Carina L. Gargalo, Simoneta Caño de las Heras, Mark Jones et al. · Advances in biochemical engineering, biotechnology | 2020 | 67 |
| 9 | All-inorganic halide-perovskite polymer-fiber-photodetector for high-speed optical wireless communication Chun Hong Kang, Omar Alkhazragi, Lutfan Sinatra et al. · Optics Express | 8 Feb 2022 | 43 |
| 10 | Efficient calculation of canonical MP2 energies Péter Pulay, Svein Sæbø, Krzysztof Woliński · Chemical Physics Letters | Aug 2001 | 43 |
| 11 | An efficient parallel algorithm for the calculation of canonical MP2 energies Jon Baker, Péter Pulay · Journal of Computational Chemistry | 26 Jun 2002 | 40 |
| 12 | Isomerization of stilbene using enforced geometry optimization Jon Baker, Krzysztof Woliński · Journal of Computational Chemistry | 19 Jul 2010 | 40 |
| 13 | The who, what, why, where, and when of it outsourcing Phillip A. Laplante, T. Costello, Prakash Singh et al. · IT Professional | 2004 | 40 |
| 14 | Perovskite-Based Artificial Multiple Quantum Wells Kwang Jae Lee, Bekir Türedi, Lutfan Sinatra et al. · Nano Letters | 22 Apr 2019 | 39 |
| 15 | Delayed Photoluminescence and Modified Blinking Statistics in Alumina-Encapsulated Zero-Dimensional Inorganic Perovskite Nanocrystals Tianle Guo, Riya Bose, Xiaohe Zhou et al. · The Journal of Physical Chemistry Letters | 15 Oct 2019 | 36 |
| 16 | Cascade Electron Transfer Induces Slow Hot Carrier Relaxation in CsPbBr3 Asymmetric Quantum Wells Partha Maity, Noor A. Merdad, Jun Li Yin et al. · ACS Energy Letters | 28 Jun 2021 | 32 |
| 17 | The Meisenheimer model for predicting the principal site for nucleophilic substitution in aromatic perfluorocarbons — Generalization to include ring-nitrogen atoms and non-fluorine ring substituents Jon Baker, Max Muir · Canadian Journal of Chemistry | Jul 2010 | 32 |
| 18 | Formulation Development and Evaluation of Fast Disintegrating Tablets of Ambroxol Hydrochloride for Pediatrics- A Novel Approach for Drug Delivery Deepak Chandra Sharma, Mankaran Singh, Dinesh K. Kumar et al. · Indian Journal of Pharmaceutical Education and Research | 16 Dec 2014 | 32 |
| 19 | Comments on the molecular geometry of ferrocene: The dangers of using quantum chemistry programs as black boxes Jason L. Martin, Jon Baker, Péter Pulay · Journal of Computational Chemistry | 8 Sep 2008 | 31 |
| 20 | Geometry optimization in the presence of external forces: a theoretical model for enforced structural changes in molecules Krzysztof Woliński, Jon Baker · Molecular Physics | 20 Jul 2010 | 31 |
| 21 | Mechanical, electronic, optical, piezoelectric and ferroic properties of strained graphene and other strained monolayers and multilayers: an update Gerardo G. Naumis, Saúl A. Herrera, Shiva Prasad Poudel et al. · Reports on Progress in Physics | 25 Oct 2023 | 30 |
| 22 | Engineering Band‐Type Alignment in CsPbBr3 Perovskite‐Based Artificial Multiple Quantum Wells Kwang Jae Lee, Noor A. Merdad, Partha Maity et al. · Advanced Materials | 24 Mar 2021 | 30 |
| 23 | An efficient atomic orbital based second-order Møller–Plesset gradient program Svein Sæbø, Jon Baker, Krzysztof Woliński et al. · The Journal of Chemical Physics | 4 Jun 2004 | 29 |
| 24 | A critical assessment of the use of compliance constants as bond strength descriptors for weak interatomic interactions Jon Baker · The Journal of Chemical Physics | 5 Jul 2006 | 27 |
| 25 | The effect of grid quality and weight derivatives in density functional calculations of harmonic vibrational frequencies Massimo Malagoli, Jon Baker · The Journal of Chemical Physics | 22 Dec 2003 | 24 |
| 26 | A simple calculational model for predicting the site for nucleophilic substitution in aromatic perfluorocarbons Max Muir, Jon Baker · Journal of Fluorine Chemistry | 14 Apr 2005 | 20 |
| 27 | Recent developments in the PQS program Jon Baker, Tomasz Janowski, Krzysztof Woliński et al. · Wiley Interdisciplinary Reviews Computational Molecular Science | 28 Jun 2011 | 19 |
| 28 | Quantum visual feature encoding revisited Xuan-Bac Nguyen, Hoang-Quan Nguyen, Hugh Churchill et al. · Quantum Machine Intelligence | 17 Sep 2024 | 16 |
| 29 | Parallel stored‐integral and semidirect Hartree–Fock and DFT methods with data compression Alexander V. Mitin, Jon Baker, Krzysztof Woliński et al. · Journal of Computational Chemistry | 9 Dec 2002 | 15 |
| 30 | Accuracy and efficiency of atomic basis set methods versus plane wave calculations with ultrasoft pseudopotentials for DNA base molecules Péter Pulay, Svein Sæbø, Massimo Malagoli et al. · Journal of Computational Chemistry | 28 Feb 2005 | 15 |
| 31 | Parallel Density Functional Theory Energies using the Fourier Transform Coulomb Method Jon Baker, László Füsti-Molnár, Péter Pulay · The Journal of Physical Chemistry A | 16 Jan 2004 | 14 |
| 32 | A scaled quantum mechanical reinvestigation of the vibrational spectrum of toluene Jon Baker · Journal of Molecular Structure THEOCHEM | 29 Jun 2008 | 13 |
| 33 | Kinetically stable high-energy isomers of C14H12 and C12H10N2 derived from cis-stilbene and cis-azobenzene Jon Baker, Krzysztof Woliński · Journal of Molecular Modeling | 13 Sep 2010 | 12 |
| 34 | Parallel implementation of Hartree–Fock and density functional theory analytical second derivatives Jon Baker, Krzysztof Woliński, Massimo Malagoli et al. · Molecular Physics | 10 Dec 2004 | 12 |
| 35 | Potassium losses in runoff from cotton production fields Mike B. Daniels, Matthew S. Fryer, Samuel B. Fernandes et al. · Agronomy Journal | 11 Mar 2023 | 11 |
| 36 | Colloidal PbS Quantum Dots for Visible-to-Near-Infrared Optical Internet of Things Aigerim Tankimanova, Chun Hong Kang, Omar Alkhazragi et al. · IEEE photonics journal | 17 Mar 2021 | 11 |
| 37 | Ab initio quantum chemistry on PC-based parallel supercomputers Jon Baker, Matt Shirel · Parallel Computing | Jul 2000 | 11 |
| 38 | P‐124: Perovskite Quantum Dots Display: Challenges and Opportunities Lutfan Sinatra, Marat Tafkilevich Lutfullin, Sergio Lentijo Mozo et al. · SID Symposium Digest of Technical Papers | 29 May 2019 | 10 |
| 39 | Parallel DFT gradients using the Fourier Transform Coulomb method Jon Baker, Krzysztof Woliński, Péter Pulay · Journal of Computational Chemistry | 7 May 2007 | 8 |
| 40 | Measurement-While-Drilling Mud Pulse Detection Process: An Investigation of Matched Filter Responses to Simulated and Real Mud Pressure Pulses J.L. Marsh, E. C. Fraser, A. L. Holt · Petroleum Computer Conference | 27 Jun 1988 | 8 |
| 41 | DEVELOPMENT AND VALIDATION OF SPECTROSCOPIC METHOD FOR SIMULTANEOUS ESTIMATION OF SALBUTAMOL SULPHATE, AMBROXOL HYDROCHLORIDE AND CETIRIZINE HYDROCHLORIDE IN COMBINED PHARMACEUTICAL TABLET FORMULATION: A NOVEL TECHNIQUE FOR IN-VITRO DISSOLUTION STUDIES Deepak Chandra Sharma, Gurmeet Singh, Dinesh K. Kumar et al. · International Journal of Pharmacy and Pharmaceutical Sciences | 4 Nov 2014 | 6 |
| 42 | Tuning magnetism in Ising-type van der Waals magnet FePS3 by lithium intercalation Dinesh Upreti, Rabindra Basnet, M. M. Sharma et al. · Journal of Physics Condensed Matter | 4 Feb 2025 | 5 |
| 43 | Compliance constants: are they of any real use? Jon Baker · Wiley Interdisciplinary Reviews Computational Molecular Science | 19 Jul 2013 | 5 |
| 44 | Preparation of Dialkylamino-Substituted Benzenes and Naphthalenes by Nucleophilic Replacement of Fluorine in the Corresponding Perfluoroaromatic Compounds Vladimir Igorevich Sorokin, Valery Anatolievich Ozeryanskii, Г. С. Бородкин et al. · Zeitschrift für Naturforschung B | May 2006 | 5 |
| 45 | Empirical evidence on the stock-bond correlation Roderick D. J. Molenaar, Edouard Sénéchal, Laurens A. P. Swinkels et al. · SSRN Electronic Journal | 2023 | 4 |
| 46 | Two-atom-thin topological crystalline insulators lacking out of plane inversion symmetry Salvador Barraza‐Lopez, Gerardo G. Naumis · Journal of Physics Condensed Matter | 8 Nov 2022 | 4 |
| 47 | The homotropenylium cation: a system with a pinched π ring current Mark Lillington, Remco W. A. Havenith, Patrick William Fowler et al. · Physical Chemistry Chemical Physics | 2014 | 4 |
| 48 | Ferroelectrically switched valley-dependent transmission in SnTe-PbTe-SnTe monolayer lateral heterostructures Kai Chang, Jing‐Rong Ji, Ziang Gao et al. · Nature Communications | 11 Dec 2025 | 3 |
| 49 | Organization and payment for molecular genetic analysis in patients with certain malignancies in the constituent entities of the Russian Federation М. В. Сура, Ирина Анатольевна Демидова, O.A. Ignatenko et al. · Medical Technologies Assessment and Choice | 6 Mar 2025 | 2 |
| 50 | Molecular Structure and Vibrational Spectra Jon Baker | 2012 | 2 |
Citations are OpenAlex's own counts, from its 2026-09-23 snapshot, so the ranking can differ from Google Scholar or Web of Science. A paper is listed for an institution when any of its authors gave it as an affiliation; retracted papers and papers whose citation count cannot be traced to citing works are left out, and a preprint and the article it became are shown once. Release dates are OpenAlex's: where a source gave only a month or a year, that is what is shown. How the lists are chosen.