Year |
Citation |
Score |
2023 |
Wang Y, Wu H, Jones LO, Mosquera MA, Stern CL, Schatz GC, Stoddart JF. Color-Tunable Upconversion-Emission Switch Based on Cocrystal-to-Cocrystal Transformation. Journal of the American Chemical Society. 145: 1855-1865. PMID 36642916 DOI: 10.1021/jacs.2c11425 |
0.404 |
|
2022 |
Jacobson G, Marmolejo-Tejada JM, Mosquera MA. Cluster Amplitudes and Their Interplay with Self-Consistency in Density Functional Methods. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. e202200592. PMID 36385578 DOI: 10.1002/cphc.202200592 |
0.359 |
|
2022 |
Mosquera MA, Marmolejo-Tejada JM, Borys NJ. Theoretical quantum model of two-dimensional propagating plexcitons. The Journal of Chemical Physics. 157: 124103. PMID 36182408 DOI: 10.1063/5.0103383 |
0.321 |
|
2022 |
Chen Y, Jones LO, Lee TL, Das A, Mosquera MA, Keane DT, Schatz GC, Bedzyk MJ. Atomic-Site-Specific Surface Valence-Band Structure from X-Ray Standing-Wave Excited Photoemission. Physical Review Letters. 128: 206801. PMID 35657902 DOI: 10.1103/PhysRevLett.128.206801 |
0.407 |
|
2022 |
Bao L, Jones LO, Garrote Cañas AM, Yan Y, Pask CM, Hardie MJ, Mosquera MA, Schatz GC, Sergeeva NN. Multipurpose made colorimetric materials for amines, pH change and metal ion detection. Rsc Advances. 12: 2684-2692. PMID 35425282 DOI: 10.1039/d1ra07811a |
0.322 |
|
2021 |
Mosquera MA. Density Functional Calculations Based on the Exponential Ansatz. The Journal of Physical Chemistry. A. 125: 8751-8763. PMID 34582684 DOI: 10.1021/acs.jpca.1c07113 |
0.381 |
|
2021 |
Mosquera MA, Jones LO, Kang G, Ratner MA, Schatz GC. Second Linear Response Theory and the Analytic Calculation of Excited-State Properties. The Journal of Physical Chemistry. A. PMID 33497573 DOI: 10.1021/acs.jpca.0c10152 |
0.762 |
|
2020 |
Leonard AA, Mosquera MA, Jones LO, Cai Z, Fauvell TJ, Kirschner MS, Gosztola DJ, Schatz GC, Schaller RD, Yu L, Chen LX. Photophysical implications of ring fusion, linker length, and twisting angle in a series of perylenediimide-thienoacene dimers. Chemical Science. 11: 7133-7143. PMID 33209244 DOI: 10.1039/D0Sc02862B |
0.533 |
|
2020 |
Wang Y, Wu H, Li P, Chen S, Jones LO, Mosquera MA, Zhang L, Cai K, Chen H, Chen XY, Stern CL, Wasielewski MR, Ratner MA, Schatz GC, Stoddart JF. Two-photon excited deep-red and near-infrared emissive organic co-crystals. Nature Communications. 11: 4633. PMID 32934231 DOI: 10.1038/S41467-020-18431-7 |
0.521 |
|
2020 |
Jones LO, Mosquera MA, Jiang Y, Weiss EA, Schatz GC, Ratner MA. Thermodynamics and Mechanism of a Photocatalyzed Stereoselective [2+2] Cycloaddition on a CdSe Quantum Dot. Journal of the American Chemical Society. PMID 32815721 DOI: 10.1021/Jacs.0C07130 |
0.663 |
|
2020 |
Li QI, Mosquera MA, Jones LO, Parakh A, Chai J, Jin R, Schatz GC, Gu XW. Pressure-Induced Optical Transitions in Metal Nanoclusters. Acs Nano. PMID 32790326 DOI: 10.1021/Acsnano.0C04813 |
0.459 |
|
2020 |
Mosquera MA, Jones LO, Borca CH, Ratner MA, Schatz GC. Domain Separated Density Functional Theory for Reaction Energy Barriers and Optical Excitations. The Journal of Physical Chemistry. A. PMID 32543853 DOI: 10.1021/Acs.Jpca.0C03596 |
0.637 |
|
2020 |
Kang G, Nasiri Avanaki K, Mosquera MA, Burdick RK, Villabona-Monsalve JP, Goodson Iii T, Schatz GC. Efficient modeling of organic chromophores for entangled two-photon absorption. Journal of the American Chemical Society. PMID 32401020 DOI: 10.1021/Jacs.0C02808 |
0.756 |
|
2020 |
Jones LO, Mosquera MA, Schatz GC, Ratner MA. Embedding Methods for Quantum Chemistry: Applications from Materials to Life Sciences. Journal of the American Chemical Society. PMID 31986877 DOI: 10.1021/Jacs.9B10780 |
0.558 |
|
2020 |
Jones LO, Mosquera MA, Ratner MA, Schatz GC. Control of Charge Carriers and Band Structure in 2D Monolayer Molybdenum Disulfide Covalent Functionalization. Acs Applied Materials & Interfaces. PMID 31898887 DOI: 10.1021/Acsami.9B19639 |
0.587 |
|
2020 |
Jones LO, Mosquera MA, Schatz GC, Marks TJ, Ratner MA. Atom vacancies and electronic transmission Stark effects in boron nanoflake junctions Journal of Materials Chemistry C. 8: 15208-15218. DOI: 10.1039/D0Tc03116J |
0.56 |
|
2020 |
Jones LO, Mosquera MA, Ratner MA, Schatz GC. Orbital Control and Coherent Charge Transport in Transition Metal Platinum(II)–Platinum(II) Lantern Complexes in Molecular Junctions The Journal of Physical Chemistry C. 124: 3233-3241. DOI: 10.1021/Acs.Jpcc.9B10093 |
0.472 |
|
2020 |
Jiang K, Mosquera MA, Oueis Y, Wasserman A. Virial relations in density embedding International Journal of Quantum Chemistry. 120. DOI: 10.1002/Qua.26204 |
0.571 |
|
2020 |
Mosquera MA, Jones LO, Ratner MA, Schatz GC. Quantum embedding for material chemistry based on domain separation and open subsystems International Journal of Quantum Chemistry. 120. DOI: 10.1002/Qua.26184 |
0.506 |
|
2019 |
Jones LO, Mosquera MA, Fu B, Schatz GC, Marks TJ, Ratner MA. Quantum Interference and Substantial Properties Tuning in Conjugated Z-Ortho-Regio-Resistive Organic (ZORRO) Junctions. Nano Letters. PMID 31682761 DOI: 10.1021/Acs.Nanolett.9B03849 |
0.588 |
|
2019 |
Jones LO, Mosquera MA, Schatz GC, Ratner MA. Molecular Junctions Inspired by Nature: Electrical Conduction through Noncovalent Nanobelts. The Journal of Physical Chemistry. B. PMID 31525929 DOI: 10.1021/Acs.Jpcb.9B06255 |
0.575 |
|
2019 |
Mosquera MA, Jones LO, Borca CH, Ratner MA, Schatz GC. Domain Separation in Density Functional Theory. The Journal of Physical Chemistry. A. PMID 31075203 DOI: 10.1021/Acs.Jpca.9B01173 |
0.636 |
|
2019 |
Jones LO, Mosquera MA, Fu B, Schatz GC, Ratner MA, Marks TJ. Germanium Fluoride Nanocages as Optically Transparent n Type Materials and their Endohedral Metallofullerene Derivatives. Journal of the American Chemical Society. PMID 30608154 DOI: 10.1021/Jacs.8B11259 |
0.575 |
|
2019 |
Wu Y, Yang M, Ueltschi TW, Mosquera MA, Chen Z, Schatz GC, Van Duyne RP. SERS Study of the Mechanism of Plasmon-Driven Hot Electron Transfer between Gold Nanoparticles and PCBM The Journal of Physical Chemistry C. 123: 29908-29915. DOI: 10.1021/Acs.Jpcc.9B10395 |
0.408 |
|
2019 |
Jones LO, Mosquera MA, Schatz GC, Ratner MA. Charge Transport and Thermoelectric Properties of Carbon Sulfide Nanobelts in Single-Molecule Sensors Chemistry of Materials. 31: 6506-6518. DOI: 10.1021/Acs.Chemmater.8B05119 |
0.578 |
|
2018 |
Mosquera MA, Ratner MA, Schatz GC. Locally coupled open subsystems: A formalism for affordable electronic structure calculations featuring fractional charges and size consistency. The Journal of Chemical Physics. 149: 034105. PMID 30037242 DOI: 10.1063/1.5038557 |
0.635 |
|
2018 |
Fu B, Mosquera MA, Schatz GC, Ratner MA, Hsu LY. Photo-Induced Anomalous Coulomb Blockade and the Role of Triplet States in Electron Transport through an Irradiated Molecular Transistor. Nano Letters. PMID 29995424 DOI: 10.1021/Acs.Nanolett.8B01838 |
0.746 |
|
2018 |
Mosquera MA, Jones LO, Ratner MA, Schatz GC. Development of formalisms based on locally coupled open subsystems for calculations in molecular electronic structure and dynamics Physical Review A. 98. DOI: 10.1103/Physreva.98.062505 |
0.571 |
|
2017 |
Mosquera MA. Support for the existence of invertible maps between electronic densities and non-analytic 1-body external potentials in non-relativistic time-dependent quantum mechanics. The Journal of Chemical Physics. 147: 134110. PMID 28987094 DOI: 10.1063/1.4991870 |
0.439 |
|
2017 |
Mosquera MA, Jackson NE, Fauvell TJ, Kelley MS, Chen LX, Schatz GC, Ratner MA. Exciton Absorption Spectra by Linear Response Methods: Application to Conjugated Polymers. Journal of the American Chemical Society. PMID 28225612 DOI: 10.1021/Jacs.6B12405 |
0.604 |
|
2017 |
Mosquera MA, Fu B, Kohlstedt KL, Schatz GC, Ratner MA. Wave Functions, Density Functionals, and Artificial Intelligence for Materials and Energy Research: Future Prospects and Challenges Acs Energy Letters. 3: 155-162. DOI: 10.1021/Acsenergylett.7B01058 |
0.617 |
|
2016 |
Yang Y, Mosquera MA, Skinner K, Becerra AE, Shamamian VA, Schatz GC, Ratner MA, Marks TJ. Electronic Structure and Potential Reactivity of Silaaromatic Molecules. The Journal of Physical Chemistry. A. PMID 27805397 DOI: 10.1021/Acs.Jpca.6B09526 |
0.58 |
|
2016 |
Mosquera MA, Chen LX, Ratner MA, Schatz GC. Sequential double excitations from linear-response time-dependent density functional theory. The Journal of Chemical Physics. 144: 204105. PMID 27250277 DOI: 10.1063/1.4950876 |
0.613 |
|
2016 |
Mosquera MA, Borca CH, Ratner MA, Schatz GC. Connection Between Hybrid Functionals and Importance of the Local Density Approximation. The Journal of Physical Chemistry. A. PMID 26901359 DOI: 10.1021/Acs.Jpca.5B10864 |
0.657 |
|
2015 |
Mosquera MA, Wasserman A. Time-Dependent Electronic Populations in Fragment-Based Time-Dependent Density Functional Theory. Journal of Chemical Theory and Computation. 11: 3530-6. PMID 26574438 DOI: 10.1021/Acs.Jctc.5B00342 |
0.673 |
|
2015 |
Mosquera MA, Wasserman A. Non-analytic Spin-Density Functionals. Topics in Current Chemistry. 365: 145-74. PMID 25896439 DOI: 10.1007/128_2014_619 |
0.604 |
|
2014 |
Mosquera MA, Wasserman A. Current density partitioning in time-dependent current density functional theory. The Journal of Chemical Physics. 140: 18A525. PMID 24832333 DOI: 10.1063/1.4867003 |
0.633 |
|
2014 |
Mosquera MA, Wasserman A. Integer discontinuity of density functional theory Physical Review A. 89. DOI: 10.1103/Physreva.89.052506 |
0.463 |
|
2014 |
Mosquera MA, Wasserman A. Derivative discontinuities in density functional theory Molecular Physics. 112: 2997-3013. DOI: 10.1080/00268976.2014.968650 |
0.647 |
|
2013 |
Mosquera MA, Jensen D, Wasserman A. Fragment-based time-dependent density functional theory. Physical Review Letters. 111: 023001. PMID 23889390 DOI: 10.1103/Physrevlett.111.023001 |
0.652 |
|
2013 |
Mosquera MA. Action formalism of time-dependent density-functional theory Physical Review A. 88. DOI: 10.1103/Physreva.88.022515 |
0.434 |
|
2013 |
Mosquera MA, Wasserman A. Partition density functional theory and its extension to the spin-polarized case Molecular Physics. 111: 505-515. DOI: 10.1080/00268976.2012.729096 |
0.607 |
|
Show low-probability matches. |