| Year |
Citation |
Score |
| 2022 |
Yost DC, Friedman AL, Hanbicki AT, Grossman JC. 2D Monolayers for Superior Transparent Electromagnetic Interference Shielding. Acs Nano. 16: 9498-9509. PMID 36350197 DOI: 10.1021/acsnano.2c02556 |
0.786 |
|
| 2022 |
Xie T, France-Lanord A, Wang Y, Lopez J, Stolberg MA, Hill M, Leverick GM, Gomez-Bombarelli R, Johnson JA, Shao-Horn Y, Grossman JC. Accelerating amorphous polymer electrolyte screening by learning to reduce errors in molecular dynamics simulated properties. Nature Communications. 13: 3415. PMID 35701416 DOI: 10.1038/s41467-022-30994-1 |
0.749 |
|
| 2022 |
Jana A, Zhu T, Wang Y, Adams JJ, Kearney LT, Naskar AK, Grossman JC, Ferralis N. Atoms to fibers: Identifying novel processing methods in the synthesis of pitch-based carbon fibers. Science Advances. 8: eabn1905. PMID 35302858 DOI: 10.1126/sciadv.abn1905 |
0.718 |
|
| 2022 |
Hu Y, Zhu T, Guo Z, Popli H, Malissa H, Huang Y, An L, Li Z, Armstrong JN, Boehme C, Vardeny ZV, N'Diaye AT, Zhou C, Wuttig M, Grossman JC, et al. Printing Air-Stable High- Molecular Magnet with Tunable Magnetic Interaction. Nano Letters. PMID 34981943 DOI: 10.1021/acs.nanolett.1c01879 |
0.643 |
|
| 2021 |
Gong S, Wang S, Zhu T, Chen X, Yang Z, Buehler MJ, Shao-Horn Y, Grossman JC. Screening and Understanding Li Adsorption on Two-Dimensional Metallic Materials by Learning Physics and Physics-Simplified Learning. Jacs Au. 1: 1904-1914. PMID 34841409 DOI: 10.1021/jacsau.1c00260 |
0.682 |
|
| 2021 |
Huang Y, Mitchell T, Yost DC, Hu Y, Benedict JB, Grossman JC, Ren S. Emerged Metallicity in Molecular Ferromagnetic Wires. Nano Letters. PMID 34757755 DOI: 10.1021/acs.nanolett.1c03663 |
0.781 |
|
| 2021 |
Huang B, Rao RR, You S, Hpone Myint K, Song Y, Wang Y, Ding W, Giordano L, Zhang Y, Wang T, Muy S, Katayama Y, Grossman JC, Willard AP, Xu K, et al. Cation- and pH-Dependent Hydrogen Evolution and Oxidation Reaction Kinetics. Jacs Au. 1: 1674-1687. PMID 34723270 DOI: 10.1021/jacsau.1c00281 |
0.457 |
|
| 2021 |
Chen J, Wang Y, Xu W, Wen Y, Ryu GH, Grossman JC, Warner JH. Atomic Structure of Dislocations and Grain Boundaries in Two-Dimensional PtSe. Acs Nano. PMID 34610239 DOI: 10.1021/acsnano.1c06736 |
0.469 |
|
| 2021 |
Hu Y, Adhikari D, Tan A, Dong X, Zhu T, Wang X, Huang Y, Mitchell T, Yao Z, Dasenbrock-Gammon N, Snider E, Dias RP, Huang C, Kim R, Neuhart I, ... ... Grossman JC, et al. Laser-Induced Cooperative Transition in Molecular Electronic Crystal. Advanced Materials (Deerfield Beach, Fla.). e2103000. PMID 34397123 DOI: 10.1002/adma.202103000 |
0.68 |
|
| 2021 |
He R, Zhu T, Ying P, Chen J, Giebeler L, Kühn U, Grossman JC, Wang Y, Nielsch K. High-Pressure-Sintering-Induced Microstructural Engineering for an Ultimate Phonon Scattering of Thermoelectric Half-Heusler Compounds. Small (Weinheim An Der Bergstrasse, Germany). e2102045. PMID 34235845 DOI: 10.1002/smll.202102045 |
0.673 |
|
| 2020 |
Crabb E, France-Lanord A, Leverick G, Stephens R, Shao-Horn Y, Grossman JC. Importance of Equilibration Method and Sampling for Molecular Dynamics Simulations of Solvent-Lithium-Salt Systems in Lithium-Oxygen Batteries. Journal of Chemical Theory and Computation. PMID 33180490 DOI: 10.1021/acs.jctc.0c00833 |
0.703 |
|
| 2020 |
Hu Y, Guo Z, Ragonese A, Zhu T, Khuje S, Li C, Grossman JC, Zhou C, Nouh M, Ren S. A 3D-printed molecular ferroelectric metamaterial. Proceedings of the National Academy of Sciences of the United States of America. PMID 33077582 DOI: 10.1073/pnas.2013934117 |
0.681 |
|
| 2020 |
Huang Y, Wolowiec C, Zhu T, Hu Y, An L, Li Z, Grossman JC, Schuller IK, Ren S. Emerging Magnetic Interactions in van der Waals Heterostructures. Nano Letters. PMID 33054240 DOI: 10.1021/acs.nanolett.0c02175 |
0.691 |
|
| 2020 |
Dahod NS, France-Lanord A, Paritmongkol W, Grossman JC, Tisdale WA. Low-frequency Raman spectrum of 2D layered perovskites: Local atomistic motion or superlattice modes? The Journal of Chemical Physics. 153: 044710. PMID 32752687 DOI: 10.1063/5.0012763 |
0.736 |
|
| 2020 |
Qiao B, Mohapatra S, Lopez J, Leverick GM, Tatara R, Shibuya Y, Jiang Y, France-Lanord A, Grossman JC, Gómez-Bombarelli R, Johnson JA, Shao-Horn Y. Quantitative Mapping of Molecular Substituents to Macroscopic Properties Enables Predictive Design of Oligoethylene Glycol-Based Lithium Electrolytes. Acs Central Science. 6: 1115-1128. PMID 32724846 DOI: 10.1021/Acscentsci.0C00475 |
0.746 |
|
| 2020 |
Nam TW, Kim M, Wang Y, Kim GY, Choi W, Lim H, Song KM, Choi MJ, Jeon DY, Grossman JC, Jung YS. Thermodynamic-driven polychromatic quantum dot patterning for light-emitting diodes beyond eye-limiting resolution. Nature Communications. 11: 3040. PMID 32546822 DOI: 10.1038/S41467-020-16865-7 |
0.481 |
|
| 2020 |
Zang X, Jian C, Ingersoll S, Li H, Adams JJ, Lu Z, Ferralis N, Grossman JC. Laser-engineered heavy hydrocarbons: Old materials with new opportunities. Science Advances. 6: eaaz5231. PMID 32494645 DOI: 10.1126/Sciadv.Aaz5231 |
0.313 |
|
| 2020 |
Sinha S, Zhu T, France-Lanord A, Sheng Y, Grossman JC, Porfyrakis K, Warner JH. Atomic structure and defect dynamics of monolayer lead iodide nanodisks with epitaxial alignment on graphene. Nature Communications. 11: 823. PMID 32041958 DOI: 10.1038/S41467-020-14481-Z |
0.78 |
|
| 2020 |
Saritas K, Fadel ER, Kozinsky B, Grossman JC. Charge Density and Redox Potential of LiNiO2 Using Ab Initio Diffusion Quantum Monte Carlo The Journal of Physical Chemistry C. 124: 5893-5901. DOI: 10.1021/Acs.Jpcc.9B10372 |
0.324 |
|
| 2020 |
Leverick G, Tatara R, Feng S, Crabb E, France-Lanord A, Tułodziecki M, Lopez J, Stephens RM, Grossman JC, Shao-Horn Y. Solvent- and Anion-Dependent Li+–O2– Coupling Strength and Implications on the Thermodynamics and Kinetics of Li–O2 Batteries The Journal of Physical Chemistry C. 124: 4953-4967. DOI: 10.1021/Acs.Jpcc.9B09968 |
0.722 |
|
| 2020 |
Wang Y, Xie T, France-Lanord A, Berkley A, Johnson JA, Shao-Horn Y, Grossman JC. Toward Designing Highly Conductive Polymer Electrolytes by Machine Learning Assisted Coarse-Grained Molecular Dynamics Chemistry of Materials. 32: 4144-4151. DOI: 10.1021/Acs.Chemmater.9B04830 |
0.751 |
|
| 2019 |
Hansen EC, Liu Y, Utzat H, Bertram SN, Grossman JC, Bawendi M. Blue Light Emitting Defective Nanocrystals Composed of Earth-Abundant Elements. Angewandte Chemie (International Ed. in English). PMID 31693785 DOI: 10.1002/Anie.201911436 |
0.432 |
|
| 2019 |
Kim Y, Wang Y, France-Lanord A, Wang Y, Wu YM, Lin S, Li Y, Grossman JC, Swager TM. Ionic Highways from Covalent Assembly in Highly Conducting and Stable Anion Exchange Membrane Fuel Cells. Journal of the American Chemical Society. PMID 31682441 DOI: 10.1021/Jacs.9B08749 |
0.744 |
|
| 2019 |
Li H, Hayden SC, France-Lanord A, Converse E, Hanna BS, Headrick T, Drake K, Grossman JC. Tuning the potential energy landscape to suppress Ostwald Ripening in surface-supported catalyst systems. Nano Letters. PMID 31674187 DOI: 10.1021/Acs.Nanolett.9B02237 |
0.727 |
|
| 2019 |
Ryu GH, Zhu T, Chen J, Sinha S, Shautsova V, Grossman JC, Warner JH. Striated 2D Lattice with Sub-nm 1D Etch Channels by Controlled Thermally Induced Phase Transformations of PdSe. Advanced Materials (Deerfield Beach, Fla.). e1904251. PMID 31559669 DOI: 10.1002/Adma.201904251 |
0.688 |
|
| 2019 |
Fadel ER, Faglioni F, Samsonidze G, Molinari N, Merinov BV, Goddard Iii WA, Grossman JC, Mailoa JP, Kozinsky B. Role of solvent-anion charge transfer in oxidative degradation of battery electrolytes. Nature Communications. 10: 3360. PMID 31350394 DOI: 10.1038/S41467-019-11317-3 |
0.311 |
|
| 2019 |
Zang X, Jian C, Zhu T, Fan Z, Wang W, Wei M, Li B, Follmar Diaz M, Ashby P, Lu Z, Chu Y, Wang Z, Ding X, Xie Y, Chen J, ... ... Grossman JC, et al. Laser-sculptured ultrathin transition metal carbide layers for energy storage and energy harvesting applications. Nature Communications. 10: 3112. PMID 31308363 DOI: 10.1038/S41467-019-10999-Z |
0.706 |
|
| 2019 |
Morris OP, Zang X, Gregg A, Keller B, Getachew B, Ingersoll S, Elsen HA, Disko MM, Ferralis N, Grossman JC. Natural Carbon By-Products for Transparent Heaters: The Case of Steam-Cracker Tar. Advanced Materials (Deerfield Beach, Fla.). e1900331. PMID 31268196 DOI: 10.1002/Adma.201900331 |
0.332 |
|
| 2019 |
Xie T, France-Lanord A, Wang Y, Shao-Horn Y, Grossman JC. Graph dynamical networks for unsupervised learning of atomic scale dynamics in materials. Nature Communications. 10: 2667. PMID 31209223 DOI: 10.1038/S41467-019-10663-6 |
0.771 |
|
| 2019 |
Liu Y, Peard N, Grossman JC. Bandlike Transport in PbS Quantum Dot Superlattices with Quantum Confinement. The Journal of Physical Chemistry Letters. PMID 31185712 DOI: 10.1021/Acs.Jpclett.9B01282 |
0.412 |
|
| 2019 |
France-Lanord A, Grossman JC. Correlations from Ion Pairing and the Nernst-Einstein Equation. Physical Review Letters. 122: 136001. PMID 31012622 DOI: 10.1103/Physrevlett.122.136001 |
0.733 |
|
| 2019 |
Jin B, Wang Y, Liu Z, France-Lanord A, Grossman JC, Jin C, Tang R. Revealing the Cluster-Cloud and Its Role in Nanocrystallization. Advanced Materials (Deerfield Beach, Fla.). e1808225. PMID 30847959 DOI: 10.1002/Adma.201808225 |
0.747 |
|
| 2019 |
Palummo M, D'Auria AN, Grossman JC, Cicero G. Tailoring the optical properties of MoS2 and WS2 single layers via organic functionalization. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 30831563 DOI: 10.1088/1361-648X/Ab0C5E |
0.337 |
|
| 2019 |
Strubbe DA, Grossman JC. Thermodynamic limits to energy conversion in solar thermal fuels. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 31: 034002. PMID 30523877 DOI: 10.1088/1361-648X/Aaef5A |
0.752 |
|
| 2019 |
Gong S, Xie T, Zhu T, Wang S, Fadel ER, Li Y, Grossman JC. Predicting charge density distribution of materials using a local-environment-based graph convolutional network Physical Review B. 100. DOI: 10.1103/Physrevb.100.184103 |
0.711 |
|
| 2019 |
Mauck CM, France-Lanord A, Hernandez Oendra AC, Dahod NS, Grossman JC, Tisdale WA. Inorganic Cage Motion Dominates Excited-State Dynamics in 2D-Layered Perovskites (CxH2x+1NH3)2PbI4 (x = 4–9) The Journal of Physical Chemistry C. 123: 27904-27916. DOI: 10.1021/Acs.Jpcc.9B07933 |
0.732 |
|
| 2019 |
France-Lanord A, Wang Y, Xie T, Johnson JA, Shao-Horn Y, Grossman JC. Effect of Chemical Variations in the Structure of Poly(ethylene oxide)-Based Polymers on Lithium Transport in Concentrated Electrolytes Chemistry of Materials. 32: 121-126. DOI: 10.1021/Acs.Chemmater.9B02645 |
0.748 |
|
| 2019 |
Jian C, Merchant S, Zang X, Ferralis N, Grossman JC. Structural evolutions of small aromatic mixtures under extreme temperature conditions: Insights from ReaxFF molecular dynamics investigations Carbon. 155: 309-319. DOI: 10.1016/J.Carbon.2019.08.048 |
0.307 |
|
| 2019 |
Li H, Zhu T, Ferralis N, Grossman JC. Charge Transport in Highly Heterogeneous Natural Carbonaceous Materials Advanced Functional Materials. 29: 1904283. DOI: 10.1002/Adfm.201904283 |
0.688 |
|
| 2018 |
Xie T, Grossman JC. Hierarchical visualization of materials space with graph convolutional neural networks. The Journal of Chemical Physics. 149: 174111. PMID 30409009 DOI: 10.1063/1.5047803 |
0.326 |
|
| 2018 |
Ryu GH, France-Lanord A, Wen Y, Zhou S, Grossman JC, Warner JH. Atomic Structure and Dynamics of Self-Limiting Sub-Nanometer Pores in Monolayer WS. Acs Nano. PMID 30375855 DOI: 10.1021/Acsnano.8B07051 |
0.739 |
|
| 2018 |
Kong W, Li H, Qiao K, Kim Y, Lee K, Nie Y, Lee D, Osadchy T, Molnar RJ, Gaskill DK, Myers-Ward RL, Daniels KM, Zhang Y, Sundram S, Yu Y, ... ... Grossman JC, et al. Polarity governs atomic interaction through two-dimensional materials. Nature Materials. PMID 30297812 DOI: 10.1038/S41563-018-0176-4 |
0.343 |
|
| 2018 |
Han GGD, Deru JH, Cho EN, Grossman JC. Optically-regulated thermal energy storage in diverse organic phase-change materials. Chemical Communications (Cambridge, England). PMID 30187043 DOI: 10.1039/C8Cc05919E |
0.311 |
|
| 2018 |
Ahmad Z, Xie T, Maheshwari C, Grossman JC, Viswanathan V. Machine Learning Enabled Computational Screening of Inorganic Solid Electrolytes for Suppression of Dendrite Formation in Lithium Metal Anodes. Acs Central Science. 4: 996-1006. PMID 30159396 DOI: 10.1021/Acscentsci.8B00229 |
0.319 |
|
| 2018 |
Chen Q, Li H, Zhou S, Xu W, Chen J, Sawada H, Allen CS, Kirkland AI, Grossman JC, Warner JH. Ultralong 1D Vacancy Channels for Rapid Atomic Migration during 2D Void Formation in Monolayer MoS. Acs Nano. PMID 30117727 DOI: 10.1021/Acsnano.8B01610 |
0.338 |
|
| 2018 |
Kim D, Han H, Lee JH, Choi JW, Grossman JC, Jang HM, Kim D. Electron-hole separation in ferroelectric oxides for efficient photovoltaic responses. Proceedings of the National Academy of Sciences of the United States of America. PMID 29891684 DOI: 10.1073/Pnas.1721503115 |
0.34 |
|
| 2018 |
Zhang Z, Li H, Miller R, Malissa H, Jamali S, Boehme C, Grossman JC, Ren S. Freestanding organic charge-transfer conformal electronics. Nano Letters. PMID 29856639 DOI: 10.1021/Acs.Nanolett.8B01342 |
0.321 |
|
| 2018 |
Xie T, Grossman JC. Crystal Graph Convolutional Neural Networks for an Accurate and Interpretable Prediction of Material Properties. Physical Review Letters. 120: 145301. PMID 29694125 DOI: 10.1103/Physrevlett.120.145301 |
0.33 |
|
| 2018 |
Liu Y, Kim D, Morris OP, Zhitomirsky D, Grossman JC. On the Origins of the Stokes Shift in PbS Quantum Dots: Impact of Polydispersity, Ligands and Defects. Acs Nano. PMID 29513986 DOI: 10.1021/Acsnano.8B00132 |
0.403 |
|
| 2017 |
Han GGD, Li H, Grossman JC. Optically-controlled long-term storage and release of thermal energy in phase-change materials. Nature Communications. 8: 1446. PMID 29133908 DOI: 10.1038/S41467-017-01608-Y |
0.338 |
|
| 2017 |
Li H, Grossman JC. Graphene Nanoribbon Based Thermoelectrics: Controllable Self- Doping and Long-Range Disorder. Advanced Science (Weinheim, Baden-Wurttemberg, Germany). 4: 1600467. PMID 28852610 DOI: 10.1002/Advs.201600467 |
0.358 |
|
| 2017 |
Chen Q, Li H, Xu W, Wang S, Sawada H, Allen CS, Kirkland AI, Grossman JC, Warner JH. Atomically Flat Zigzag Edges in Monolayer MoS2 by Thermal Annealing. Nano Letters. PMID 28799770 DOI: 10.1021/Acs.Nanolett.7B02192 |
0.353 |
|
| 2017 |
Lee W, Li H, Wong AB, Zhang D, Lai M, Yu Y, Kong Q, Lin E, Urban JJ, Grossman JC, Yang P. Ultralow thermal conductivity in all-inorganic halide perovskites. Proceedings of the National Academy of Sciences of the United States of America. PMID 28760988 DOI: 10.1073/Pnas.1711744114 |
0.339 |
|
| 2017 |
Wang S, Li H, Zhang J, Guo S, Xu W, Grossman JC, Warner JH. Epitaxial Templating of Two-Dimensional Metal Chloride Nanocrystals on Monolayer Molybdenum Disulfide. Acs Nano. PMID 28605178 DOI: 10.1021/Acsnano.7B02838 |
0.367 |
|
| 2017 |
Wang S, Li H, Sawada H, Allen CS, Kirkland AI, Grossman JC, Warner JH. Atomic structure and formation mechanism of sub-nanometer pores in 2D monolayer MoS2. Nanoscale. PMID 28463370 DOI: 10.1039/C7Nr01127J |
0.322 |
|
| 2017 |
Saritas K, Mueller T, Wagner L, Grossman JC. Investigation of a quantum Monte Carlo protocol to achieve high accuracy and high throughput materials formation energies. Journal of Chemical Theory and Computation. PMID 28358499 DOI: 10.1021/Acs.Jctc.6B01179 |
0.351 |
|
| 2017 |
Li H, Wang S, Sawada H, Han GG, Samuels T, Allen CS, Kirkland AI, Grossman JC, Warner JH. Atomic Structure and Dynamics of Single Platinum Atom Interactions with Monolayer MoS2. Acs Nano. PMID 28256826 DOI: 10.1021/Acsnano.7B00796 |
0.332 |
|
| 2017 |
Cho EN, Zhitomirsky D, Han GG, Liu Y, Grossman JC. Molecularly Engineered Azobenzene Derivatives for High Energy Density Solid-State Solar Thermal Fuels. Acs Applied Materials & Interfaces. PMID 28234453 DOI: 10.1021/Acsami.6B15018 |
0.427 |
|
| 2017 |
Bardhan NM, Kumar PV, Li Z, Ploegh HL, Grossman JC, Belcher AM, Chen GY. Enhanced Cell Capture on Functionalized Graphene Oxide Nanosheets through Oxygen Clustering. Acs Nano. PMID 28085249 DOI: 10.1021/Acsnano.6B06979 |
0.318 |
|
| 2017 |
Bernardi M, Ataca C, Palummo M, Grossman JC. Optical and Electronic Properties of Two-Dimensional Layered Materials Nanophotonics. 6: 479-493. DOI: 10.1515/Nanoph-2015-0030 |
0.347 |
|
| 2017 |
Romano G, Grossman JC. Phonon bottleneck identification in disordered nanoporous materials Physical Review B. 96. DOI: 10.1103/Physrevb.96.115425 |
0.35 |
|
| 2017 |
Risplendi F, Cicero G, Grossman JC. Nanostructured Bulk-Heterojunction Solar Cells Based on Amorphous Carbon Acs Energy Letters. 2: 882-888. DOI: 10.1021/Acsenergylett.7B00166 |
0.376 |
|
| 2017 |
Saritas K, Grossman JC. Accurate Isomerization Enthalpy and Investigation of the Errors in Density Functional Theory for Dihydroazulene/Vinylheptafulvene Photochromism Using Diffusion Monte Carlo The Journal of Physical Chemistry C. 121: 26677-26685. DOI: 10.1021/Acs.Jpcc.7B09437 |
0.318 |
|
| 2017 |
Zhang Z, Li H, Luo Z, Chang S, Li Z, Guan M, Zhou Z, Liu M, Grossman JC, Ren S. Molecular Assembly-Induced Charge Transfer for Programmable Functionalities Chemistry of Materials. 29: 9851-9858. DOI: 10.1021/Acs.Chemmater.7B04357 |
0.332 |
|
| 2017 |
Keller BD, Bertuch A, Provine J, Sundaram G, Ferralis N, Grossman JC. Process Control of Atomic Layer Deposition Molybdenum Oxide Nucleation and Sulfidation to Large-Area MoS2 Monolayers Chemistry of Materials. 29: 2024-2032. DOI: 10.1021/Acs.Chemmater.6B03951 |
0.303 |
|
| 2017 |
Oh J, Yoo H, Choi J, Kim JY, Lee DS, Kim MJ, Lee J, Kim WN, Grossman JC, Park JH, Lee S, Kim H, Son JG. Significantly reduced thermal conductivity and enhanced thermoelectric properties of single- and bi-layer graphene nanomeshes with sub-10 nm neck-width Nano Energy. 35: 26-35. DOI: 10.1016/J.Nanoen.2017.03.019 |
0.328 |
|
| 2017 |
Dave SH, Keller BD, Golmer K, Grossman JC. Six Degrees of Separation: Connecting Research with Users and Cost Analysis Joule. 1: 410-415. DOI: 10.1016/J.Joule.2017.08.021 |
0.328 |
|
| 2017 |
Mauro A, Grossman JC. Street-heat: Controlling road temperature via low enthalpy geothermal energy Applied Thermal Engineering. 110: 1653-1658. DOI: 10.1016/J.Applthermaleng.2016.08.180 |
0.312 |
|
| 2017 |
Han GGD, Tu K, Niroui F, Xu W, Zhou S, Wang X, Bulović V, Ross CA, Warner JH, Grossman JC. Photoluminescent Arrays of Nanopatterned Monolayer MoS2 Advanced Functional Materials. 27: 1703688. DOI: 10.1002/Adfm.201703688 |
0.368 |
|
| 2016 |
Zhitomirsky D, Grossman JC. Conformal Electroplating of Azobenzene-Based Solar Thermal Fuels onto Large Area and Fiber Geometries. Acs Applied Materials & Interfaces. PMID 27611884 DOI: 10.1021/Acsami.6B08034 |
0.349 |
|
| 2016 |
Dave SH, Gong C, Robertson AW, Warner JH, Grossman JC. Chemistry and Structure of Graphene Oxide via Direct Imaging. Acs Nano. PMID 27397115 DOI: 10.1021/Acsnano.6B02391 |
0.315 |
|
| 2016 |
Kim JY, Grossman JC. Optimization of the Thermoelectric Figure of Merit in Crystalline C60 with Intercalation Chemistry. Nano Letters. PMID 27322341 DOI: 10.1021/Acs.Nanolett.6B01073 |
0.355 |
|
| 2016 |
Cai H, Soignard E, Ataca C, Chen B, Ko C, Aoki T, Pant A, Meng X, Yang S, Grossman J, Ogletree FD, Tongay S. Band Engineering by Controlling vdW Epitaxy Growth Mode in 2D Gallium Chalcogenides. Advanced Materials (Deerfield Beach, Fla.). PMID 27271214 DOI: 10.1002/Adma.201601184 |
0.316 |
|
| 2016 |
Johlin E, Al-Obeidi A, Nogay G, Stuckelberger M, Buonassisi T, Grossman JC. Nanohole Structuring for Improved Performance of Hydrogenated Amorphous Silicon Photovoltaics. Acs Applied Materials & Interfaces. PMID 27227369 DOI: 10.1021/Acsami.6B00033 |
0.769 |
|
| 2016 |
Raffone F, Ataca C, Grossman JC, Cicero G. MoS2 Enhanced T-Phase Stabilization and Tunability Through Alloying. The Journal of Physical Chemistry Letters. PMID 27225447 DOI: 10.1021/Acs.Jpclett.6B00794 |
0.312 |
|
| 2016 |
Keller BD, Ferralis N, Grossman JC. Rethinking Coal: Thin Films of Solution Processed Natural Carbon Nanoparticles for Electronic Devices. Nano Letters. PMID 27031328 DOI: 10.1021/Acs.Nanolett.5B04735 |
0.338 |
|
| 2016 |
Xu B, Li H, Li H, Wilson AJ, Zhang L, Chen K, Willets K, Ren F, Grossman JC, Ren S. Chemically driven interfacial coupling in charge-transfer mediated functional superstructures. Nano Letters. PMID 26999430 DOI: 10.1021/Acs.Nanolett.6B00712 |
0.305 |
|
| 2016 |
Smith BD, Patil JJ, Ferralis N, Grossman JC. Catalyst Self-Assembly for Scalable Patterning of Sub 10 nm Ultrahigh Aspect Ratio Nanopores in Silicon. Acs Applied Materials & Interfaces. PMID 26999295 DOI: 10.1021/Acsami.6B01927 |
0.3 |
|
| 2016 |
Ko DK, Maurano A, Suh SK, Kim D, Hwang GW, Grossman JC, Bulović V, Bawendi MG. Photovoltaic Performance of PbS Quantum Dots Treated with Metal Salts. Acs Nano. PMID 26909739 DOI: 10.1021/Acsnano.5B07186 |
0.317 |
|
| 2016 |
Yang S, Wang C, Ataca C, Li Y, Chen H, Cai H, Suslu A, Grossman JC, Jiang C, Liu Q, Tongay S. Self-Driven Photodetector and Ambipolar Transistor in Atomically Thin GaTe-MoS2 p-n vdW Heterostructure. Acs Applied Materials & Interfaces. PMID 26796869 DOI: 10.1021/Acsami.5B10001 |
0.366 |
|
| 2016 |
Koh AL, Wang S, Ataca C, Grossman JC, Sinclair R, Warner JH. Torsional Deformations in Subnanometer MoS Interconnecting Wires. Nano Letters. PMID 26785319 DOI: 10.1021/Acs.Nanolett.5B04507 |
0.321 |
|
| 2016 |
Li H, Zhitomirsky D, Dave S, Grossman JC. Towards the Ultimate Limit of Connectivity in Quantum Dots with High Mobility and Clean Gaps. Acs Nano. PMID 26743175 DOI: 10.1021/Acsnano.5B05626 |
0.382 |
|
| 2016 |
Han GD, Park SS, Liu Y, Zhitomirsky D, Cho E, Dincă M, Grossman JC. Photon energy storage materials with high energy densities based on diacetylene–azobenzene derivatives Journal of Materials Chemistry A. 4: 16157-16165. DOI: 10.1039/C6Ta07086H |
0.415 |
|
| 2016 |
Bernardi M, Grossman JC. Computer calculations across time and length scales in photovoltaic solar cells Energy and Environmental Science. 9: 2197-2218. DOI: 10.1039/C6Ee01010E |
0.31 |
|
| 2016 |
Li H, Zhitomirsky D, Grossman JC. Tunable and Energetically Robust PbS Nanoplatelets for Optoelectronic Applications Chemistry of Materials. 28: 1888-1896. DOI: 10.1021/Acs.Chemmater.6B00167 |
0.357 |
|
| 2016 |
Liu Y, Ferralis N, Bryndzia LT, Grossman JC. Genome-inspired molecular identification in organic matter via Raman spectroscopy Carbon. 101: 361-367. DOI: 10.1016/J.Carbon.2016.02.017 |
0.386 |
|
| 2016 |
Kumar PV, Bardhan NM, Chen GY, Li Z, Belcher AM, Grossman JC. New insights into the thermal reduction of graphene oxide: Impact of oxygen clustering Carbon. 100: 90-98. DOI: 10.1016/J.Carbon.2015.12.087 |
0.309 |
|
| 2015 |
Hwang GW, Kim D, Cordero JM, Wilson MW, Chuang CM, Grossman JC, Bawendi MG. Identifying and Eliminating Emissive Sub-bandgap States in Thin Films of PbS Nanocrystals. Advanced Materials (Deerfield Beach, Fla.). PMID 26134373 DOI: 10.1002/Adma.201501156 |
0.301 |
|
| 2015 |
Manzano H, Durgun E, Lopez Arbeloa I, Grossman JC. Insight on Tricalcium Silicate Hydration and Dissolution Mechanism from Molecular Simulations. Acs Applied Materials & Interfaces. PMID 26107551 DOI: 10.1021/Acsami.5B02505 |
0.318 |
|
| 2015 |
Palummo M, Bernardi M, Grossman JC. Exciton radiative lifetimes in two-dimensional transition metal dichalcogenides. Nano Letters. 15: 2794-800. PMID 25798735 DOI: 10.1021/Nl503799T |
0.335 |
|
| 2015 |
Romano G, Grossman JC. Heat conduction in nanostructured materials predicted by phonon bulk mean free path distribution Journal of Heat Transfer. 137. DOI: 10.1115/1.4029775 |
0.351 |
|
| 2015 |
Strubbe DA, Johlin EC, Kirkpatrick TR, Buonassisi T, Grossman JC. Stress effects on the Raman spectrum of an amorphous material: Theory and experiment on a -Si:H Physical Review B - Condensed Matter and Materials Physics. 92. DOI: 10.1103/Physrevb.92.241202 |
0.767 |
|
| 2015 |
Saritas K, Ataca C, Grossman JC. Predicting electronic structure in tricalcium silicate phases with impurities using first-principles Journal of Physical Chemistry C. 119: 5074-5079. DOI: 10.1021/Jp510597E |
0.35 |
|
| 2015 |
Ferralis N, Liu Y, Bake KD, Pomerantz AE, Grossman JC. Direct correlation between aromatization of carbon-rich organic matter and its visible electronic absorption edge Carbon. 88: 139-147. DOI: 10.1016/J.Carbon.2015.02.075 |
0.404 |
|
| 2015 |
Zhitomirsky D, Cho E, Grossman JC. Solid-State Solar Thermal Fuels for Heat Release Applications Advanced Energy Materials. DOI: 10.1002/Aenm.201502006 |
0.323 |
|
| 2015 |
Li H, Strubbe DA, Grossman JC. Functionalized Graphene Superlattice as a Single-Sheet Solar Cell Advanced Functional Materials. 25: 5199-5205. DOI: 10.1002/Adfm.201501906 |
0.741 |
|
| 2014 |
Liu Y, Grossman JC. Accelerating the design of solar thermal fuel materials through high throughput simulations. Nano Letters. 14: 7046-50. PMID 25372463 DOI: 10.1021/Nl5034073 |
0.46 |
|
| 2014 |
Musso T, Kumar PV, Foster AS, Grossman JC. Graphene oxide as a promising hole injection layer for MoS₂-based electronic devices. Acs Nano. 8: 11432-9. PMID 25347209 DOI: 10.1021/Nn504507U |
0.328 |
|
| 2014 |
Börjesson K, ?oso D, Gray V, Grossman JC, Guan J, Harris CB, Hertkorn N, Hou Z, Kanai Y, Lee D, Lomont JP, Majumdar A, Meier SK, Moth-Poulsen K, Myrabo RL, et al. Exploring the potential of fulvalene dimetals as platforms for molecular solar thermal energy storage: computations, syntheses, structures, kinetics, and catalysis. Chemistry (Weinheim An Der Bergstrasse, Germany). 20: 15587-604. PMID 25284044 DOI: 10.1002/Chem.201404170 |
0.722 |
|
| 2014 |
Raghunathan R, Johlin E, Grossman JC. Grain boundary engineering for improved thin silicon photovoltaics. Nano Letters. 14: 4943-50. PMID 24963798 DOI: 10.1021/Nl501020Q |
0.773 |
|
| 2014 |
Brown PR, Kim D, Lunt RR, Zhao N, Bawendi MG, Grossman JC, Bulovi? V. Energy level modification in lead sulfide quantum dot thin films through ligand exchange. Acs Nano. 8: 5863-72. PMID 24824726 DOI: 10.1021/Nn500897C |
0.32 |
|
| 2014 |
Kucharski TJ, Ferralis N, Kolpak AM, Zheng JO, Nocera DG, Grossman JC. Templated assembly of photoswitches significantly increases the energy-storage capacity of solar thermal fuels. Nature Chemistry. 6: 441-7. PMID 24755597 DOI: 10.1038/Nchem.1918 |
0.783 |
|
| 2014 |
Kumar PV, Bardhan NM, Tongay S, Wu J, Belcher AM, Grossman JC. Scalable enhancement of graphene oxide properties by thermally driven phase transformation. Nature Chemistry. 6: 151-8. PMID 24451592 DOI: 10.1038/Nchem.1820 |
0.345 |
|
| 2014 |
Johlin E, Simmons CB, Buonassisi T, Grossman JC. Hole-mobility-limiting atomic structures in hydrogenated amorphous silicon Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.104103 |
0.761 |
|
| 2014 |
Mueller T, Johlin E, Grossman JC. Origins of hole traps in hydrogenated nanocrystalline and amorphous silicon revealed through machine learning Physical Review B - Condensed Matter and Materials Physics. 89. DOI: 10.1103/Physrevb.89.115202 |
0.746 |
|
| 2014 |
Risplendi F, Bernardi M, Cicero G, Grossman JC. Structure-property relations in amorphous carbon for photovoltaics Applied Physics Letters. 105. DOI: 10.1063/1.4891498 |
0.37 |
|
| 2014 |
Romano G, Grossman JC. Toward phonon-boundary engineering in nanoporous materials Applied Physics Letters. 105. DOI: 10.1063/1.4891362 |
0.325 |
|
| 2014 |
Kucharski TJ, Ferralis N, Kolpak AM, Zheng JO, Nocera DG, Grossman JC. Templated assembly of photoswitches significantly increases the energy-storage capacity of solar thermal fuels Nature Chemistry. 6: 441-447. DOI: 10.1038/nchem1918 |
0.756 |
|
| 2013 |
Durgun E, Grossman JC. Photoswitchable Molecular Rings for Solar-Thermal Energy Storage. The Journal of Physical Chemistry Letters. 4: 854-60. PMID 26291346 DOI: 10.1021/Jz301877N |
0.334 |
|
| 2013 |
Johlin E, Wagner LK, Buonassisi T, Grossman JC. Origins of structural hole traps in hydrogenated amorphous silicon. Physical Review Letters. 110: 146805. PMID 25167024 DOI: 10.1103/Physrevlett.110.146805 |
0.769 |
|
| 2013 |
Tongay S, Suh J, Ataca C, Fan W, Luce A, Kang JS, Liu J, Ko C, Raghunathanan R, Zhou J, Ogletree F, Li J, Grossman JC, Wu J. Defects activated photoluminescence in two-dimensional semiconductors: interplay between bound, charged, and free excitons. Scientific Reports. 3: 2657. PMID 24029823 DOI: 10.1038/Srep02657 |
0.339 |
|
| 2013 |
Bernardi M, Palummo M, Grossman JC. Extraordinary sunlight absorption and one nanometer thick photovoltaics using two-dimensional monolayer materials. Nano Letters. 13: 3664-70. PMID 23750910 DOI: 10.1021/Nl401544Y |
0.341 |
|
| 2013 |
Kim D, Kim DH, Lee JH, Grossman JC. Impact of stoichiometry on the electronic structure of PbS quantum dots. Physical Review Letters. 110: 196802. PMID 23705733 DOI: 10.1103/Physrevlett.110.196802 |
0.314 |
|
| 2013 |
Tongay S, Zhou J, Ataca C, Liu J, Kang JS, Matthews TS, You L, Li J, Grossman JC, Wu J. Broad-range modulation of light emission in two-dimensional semiconductors by molecular physisorption gating. Nano Letters. 13: 2831-6. PMID 23627637 DOI: 10.1021/Nl4011172 |
0.325 |
|
| 2013 |
Kumar PV, Bernardi M, Grossman JC. The impact of functionalization on the stability, work function, and photoluminescence of reduced graphene oxide. Acs Nano. 7: 1638-45. PMID 23368710 DOI: 10.1021/Nn305507P |
0.336 |
|
| 2013 |
Kolpak AM, Grossman JC. Hybrid chromophore/template nanostructures: a customizable platform material for solar energy storage and conversion. The Journal of Chemical Physics. 138: 034303. PMID 23343272 DOI: 10.1063/1.4773306 |
0.34 |
|
| 2013 |
Ertekin E, Wagner LK, Grossman JC. Point-defect optical transitions and thermal ionization energies from quantum Monte Carlo methods: Application to the F-center defect in MgO Physical Review B - Condensed Matter and Materials Physics. 87. DOI: 10.1103/Physrevb.87.155210 |
0.336 |
|
| 2013 |
Newman BK, Ertekin E, Sullivan JT, Winkler MT, Marcus MA, Fakra SC, Sher MJ, Mazur E, Grossman JC, Buonassisi T. Extended X-ray absorption fine structure spectroscopy of selenium-hyperdoped silicon Journal of Applied Physics. 114. DOI: 10.1063/1.4824279 |
0.333 |
|
| 2012 |
Tongay S, Zhou J, Ataca C, Lo K, Matthews TS, Li J, Grossman JC, Wu J. Thermally driven crossover from indirect toward direct bandgap in 2D semiconductors: MoSe2 versus MoS2. Nano Letters. 12: 5576-80. PMID 23098085 DOI: 10.1021/Nl302584W |
0.334 |
|
| 2012 |
Bernardi M, Palummo M, Grossman JC. Semiconducting monolayer materials as a tunable platform for excitonic solar cells. Acs Nano. 6: 10082-9. PMID 23062107 DOI: 10.1021/Nn303815Z |
0.373 |
|
| 2012 |
Bernardi M, Palummo M, Grossman JC. Optoelectronic properties in monolayers of hybridized graphene and hexagonal boron nitride. Physical Review Letters. 108: 226805. PMID 23003640 DOI: 10.1103/Physrevlett.108.226805 |
0.322 |
|
| 2012 |
Kim JY, Lee JH, Grossman JC. Thermal transport in functionalized graphene. Acs Nano. 6: 9050-7. PMID 22973878 DOI: 10.1021/Nn3031595 |
0.319 |
|
| 2012 |
Bernardi M, Lohrman J, Kumar PV, Kirkeminde A, Ferralis N, Grossman JC, Ren S. Nanocarbon-based photovoltaics. Acs Nano. 6: 8896-903. PMID 22953746 DOI: 10.1021/Nn302893P |
0.339 |
|
| 2012 |
Harpham MR, Nguyen SC, Hou Z, Grossman JC, Harris CB, Mara MW, Stickrath AB, Kanai Y, Kolpak AM, Lee D, Liu DJ, Lomont JP, Moth-Poulsen K, Vinokurov N, Chen LX, et al. X-ray transient absorption and picosecond IR spectroscopy of fulvalene(tetracarbonyl)diruthenium on photoexcitation. Angewandte Chemie (International Ed. in English). 51: 7692-6. PMID 22740313 DOI: 10.1002/Anie.201202952 |
0.618 |
|
| 2012 |
Wagner LK, Majzoub EH, Allendorf MD, Grossman JC. Tuning metal hydride thermodynamics via size and composition: Li-H, Mg-H, Al-H, and Mg-Al-H nanoclusters for hydrogen storage. Physical Chemistry Chemical Physics : Pccp. 14: 6611-6. PMID 22456531 DOI: 10.1039/C2Cp24063G |
0.302 |
|
| 2012 |
Ertekin E, Winkler MT, Recht D, Said AJ, Aziz MJ, Buonassisi T, Grossman JC. Insulator-to-metal transition in selenium-hyperdoped silicon: observation and origin. Physical Review Letters. 108: 026401. PMID 22324699 DOI: 10.1103/Physrevlett.108.026401 |
0.317 |
|
| 2012 |
Ertekin E, Srinivasan V, Ravichandran J, Rossen PB, Siemons W, Majumdar A, Ramesh R, Grossman JC. Interplay between intrinsic defects, doping, and free carrier concentration in SrTiO 3 thin films Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.195460 |
0.494 |
|
| 2012 |
Johlin E, Tabet N, Castro-Galnares S, Abdallah A, Bertoni MI, Asafa T, Grossman JC, Said S, Buonassisi T. Structural origins of intrinsic stress in amorphous silicon thin films Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.075202 |
0.742 |
|
| 2012 |
Bernardi M, Ferralis N, Wan JH, Villalon R, Grossman JC. Solar energy generation in three dimensions Energy and Environmental Science. 5: 6880-6884. DOI: 10.1039/C2Ee21170J |
0.324 |
|
| 2012 |
Durgun E, Manzano H, Pellenq RJM, Grossman JC. Understanding and controlling the reactivity of the calcium silicate phases from first principles Chemistry of Materials. 24: 1262-1267. DOI: 10.1021/Cm203127M |
0.311 |
|
| 2012 |
Romano G, Di Carlo A, Grossman JC. Mesoscale modeling of phononic thermal conductivity of porous Si: Interplay between porosity, morphology and surface roughness Journal of Computational Electronics. 11: 8-13. DOI: 10.1007/S10825-012-0390-2 |
0.328 |
|
| 2011 |
Ren S, Bernardi M, Lunt RR, Bulovic V, Grossman JC, Grade?ak S. Toward efficient carbon nanotube/P3HT solar cells: active layer morphology, electrical, and optical properties. Nano Letters. 11: 5316-21. PMID 22023484 DOI: 10.1021/Nl202796U |
0.325 |
|
| 2011 |
Kolpak AM, Grossman JC. Azobenzene-functionalized carbon nanotubes as high-energy density solar thermal fuels. Nano Letters. 11: 3156-62. PMID 21688811 DOI: 10.1021/Nl201357N |
0.338 |
|
| 2011 |
Cho J, Berbil-Bautista L, Pechenezhskiy IV, Levy N, Meier SK, Srinivasan V, Kanai Y, Grossman JC, Vollhardt KP, Crommie MF. Single-molecule-resolved structural changes induced by temperature and light in surface-bound organometallic molecules designed for energy storage. Acs Nano. 5: 3701-6. PMID 21480634 DOI: 10.1021/Nn2000367 |
0.726 |
|
| 2011 |
He Y, Donadio D, Lee JH, Grossman JC, Galli G. Thermal transport in nanoporous silicon: interplay between disorder at mesoscopic and atomic scales. Acs Nano. 5: 1839-44. PMID 21309558 DOI: 10.1021/Nn2003184 |
0.324 |
|
| 2011 |
Bernardi M, Giulianini M, Motta N, Grossman JC. Evidence of conjugation enhancement in P3HT/SWNT mixtures for organic photovoltaics Materials Research Society Symposium Proceedings. 1286: 126-134. DOI: 10.1557/Opl.2011.237 |
0.311 |
|
| 2011 |
Manzano H, Durgun E, Abdolhosseine Qomi MJ, Ulm FJ, Pellenq RJM, Grossman JC. Impact of chemical impurities on the crystalline cement clinker phases determined by atomistic simulations Crystal Growth and Design. 11: 2964-2972. DOI: 10.1021/Cg200212C |
0.321 |
|
| 2010 |
Bernardi M, Giulianini M, Grossman JC. Self-assembly and its impact on interfacial charge transfer in carbon nanotube/P3HT solar cells. Acs Nano. 4: 6599-606. PMID 21028847 DOI: 10.1021/Nn1018297 |
0.328 |
|
| 2010 |
Kanai Y, Srinivasan V, Meier SK, Vollhardt KP, Grossman JC. Mechanism of thermal reversal of the (fulvalene)tetracarbonyldiruthenium photoisomerization: toward molecular solar-thermal energy storage. Angewandte Chemie (International Ed. in English). 49: 8926-9. PMID 20949567 DOI: 10.1002/Anie.201002994 |
0.75 |
|
| 2010 |
Wagner LK, Grossman JC. Quantum Monte Carlo calculations for minimum energy structures. Physical Review Letters. 104: 210201. PMID 20867077 DOI: 10.1103/Physrevlett.104.210201 |
0.317 |
|
| 2010 |
Kanai Y, Khalap VR, Collins PG, Grossman JC. Atomistic oxidation mechanism of a carbon nanotube in nitric acid. Physical Review Letters. 104: 066401. PMID 20366836 DOI: 10.1103/Physrevlett.104.066401 |
0.638 |
|
| 2010 |
Lee JH, Wu J, Grossman JC. Enhancing the thermoelectric power factor with highly mismatched isoelectronic doping. Physical Review Letters. 104: 016602. PMID 20366377 DOI: 10.1103/Physrevlett.104.016602 |
0.301 |
|
| 2010 |
Kanai Y, Neaton JB, Grossman JC. Theory and simulation of nanostructured materials for photovoltaic applications Computing in Science and Engineering. 12: 18-27. DOI: 10.1109/Mcse.2010.50 |
0.675 |
|
| 2010 |
Kanai Y, Neaton J, Grossman J. Simulation of Nanostructured Materials for Solar Energy Conversion Computing in Science and Engineering. DOI: 10.1109/Mcse.2010.25 |
0.666 |
|
| 2010 |
Kanai Y, Wu Z, Grossman JC. Charge separation in nanoscale photovoltaic materials: Recent insights from first-principles electronic structure theory Journal of Materials Chemistry. 20: 1053-1061. DOI: 10.1039/B913277P |
0.679 |
|
| 2009 |
Cao J, Ertekin E, Srinivasan V, Fan W, Huang S, Zheng H, Yim JW, Khanal DR, Ogletree DF, Grossman JC, Wu J. Strain engineering and one-dimensional organization of metal-insulator domains in single-crystal vanadium dioxide beams. Nature Nanotechnology. 4: 732-7. PMID 19893528 DOI: 10.1038/Nnano.2009.266 |
0.534 |
|
| 2009 |
Wu Z, Allendorf MD, Grossman JC. Quantum Monte Carlo simulation of nanoscale MgH2 cluster thermodynamics. Journal of the American Chemical Society. 131: 13918-9. PMID 19739635 DOI: 10.1021/Ja905639M |
0.341 |
|
| 2009 |
Wu Z, Neaton JB, Grossman JC. Charge separation via strain in silicon nanowires. Nano Letters. 9: 2418-22. PMID 19462970 DOI: 10.1021/Nl9010854 |
0.318 |
|
| 2009 |
Wu Z, Kanai Y, Grossman JC. Quantum Monte Carlo calculations of the energy-level alignment at hybrid interfaces: Role of many-body effects Physical Review B - Condensed Matter and Materials Physics. 79. DOI: 10.1103/Physrevb.79.201309 |
0.648 |
|
| 2009 |
Kanai Y, Grossman JC. Role of exchange in density-functional theory for weakly interacting systems: Quantum Monte Carlo analysis of electron density and interaction energy Physical Review a - Atomic, Molecular, and Optical Physics. 80. DOI: 10.1103/Physreva.80.032504 |
0.671 |
|
| 2008 |
Wagner LK, Grossman JC. Microscopic description of light induced defects in amorphous silicon solar cells. Physical Review Letters. 101: 265501. PMID 19437650 DOI: 10.1103/Physrevlett.101.265501 |
0.344 |
|
| 2008 |
Srinivasan V, Cicero G, Grossman JC. Adsorption-induced surface stresses in alkanethiolate-au self-assembled monolayers. Physical Review Letters. 101: 185504. PMID 18999840 DOI: 10.1103/Physrevlett.101.185504 |
0.499 |
|
| 2008 |
Lee JH, Galli GA, Grossman JC. Nanoporous Si as an efficient thermoelectric material. Nano Letters. 8: 3750-4. PMID 18947211 DOI: 10.1021/Nl802045F |
0.366 |
|
| 2008 |
Wu Z, Grossman JC. Prediction of ultra-high aspect ratio nanowires from self-assembly. Nano Letters. 8: 2697-705. PMID 18698731 DOI: 10.1021/Nl801025C |
0.348 |
|
| 2008 |
Wu Z, Neaton JB, Grossman JC. Quantum confinement and electronic properties of tapered silicon nanowires. Physical Review Letters. 100: 246804. PMID 18643610 DOI: 10.1103/Physrevlett.100.246804 |
0.358 |
|
| 2008 |
Kanai Y, Grossman JC. Role of semiconducting and metallic tubes in P3HT/carbon-nanotube photovoltaic heterojunctions: density functional theory calculations. Nano Letters. 8: 908-12. PMID 18290634 DOI: 10.1021/Nl0732777 |
0.647 |
|
| 2008 |
Cicero G, Grossman JC, Schwegler E, Gygi F, Galli G. Water confined in nanotubes and between graphene sheets: a first principle study. Journal of the American Chemical Society. 130: 1871-8. PMID 18211065 DOI: 10.1021/Ja074418+ |
0.345 |
|
| 2008 |
Kanai Y, Grossman JC. QMC assessments of weak-interaction described by dft within various xc approximations / effects of carbon nanotube oxidation on molecular interactions Materials Research Society Symposium Proceedings. 1084: 1-14. DOI: 10.1557/Proc-1084-S05-03 |
0.618 |
|
| 2007 |
Friddle RW, Lemieux MC, Cicero G, Artyukhin AB, Tsukruk VV, Grossman JC, Galli G, Noy A. Single functional group interactions with individual carbon nanotubes. Nature Nanotechnology. 2: 692-7. PMID 18654407 DOI: 10.1038/Nnano.2007.334 |
0.307 |
|
| 2007 |
Kanai Y, Grossman JC. Insights on interfacial charge transfer across P3HT/fullerene photovoltaic heterojunction from Ab initio calculations. Nano Letters. 7: 1967-72. PMID 17547466 DOI: 10.1021/Nl0707095 |
0.652 |
|
| 2007 |
Greaney PA, Grossman JC. Nanomechanical energy transfer and resonance effects in single-walled carbon nanotubes. Physical Review Letters. 98: 125503. PMID 17501135 DOI: 10.1103/Physrevlett.98.125503 |
0.324 |
|
| 2007 |
Lee JH, Grossman JC, Reed J, Galli G. Lattice thermal conductivity of nanoporous Si: Molecular dynamics study Applied Physics Letters. 91. DOI: 10.1063/1.2817739 |
0.327 |
|
| 2007 |
Lee S, Zhitomirsky D, Grossman JC. Manipulating Electronic Energy Disorder in Colloidal Quantum Dot Solids for Enhanced Charge Carrier Transport Advanced Functional Materials. DOI: 10.1002/Adfm.201504816 |
0.342 |
|
| 2005 |
Prendergast D, Grossman JC, Galli G. The electronic structure of liquid water within density-functional theory. The Journal of Chemical Physics. 123: 014501. PMID 16035849 DOI: 10.1063/1.1940612 |
0.332 |
|
| 2005 |
Cicero G, Grossman JC, Catellani A, Galli G. Water at a hydrophilic solid surface probed by ab initio molecular dynamics: inhomogeneous thin layers of dense fluid. Journal of the American Chemical Society. 127: 6830-5. PMID 15869306 DOI: 10.1021/Ja042963U |
0.316 |
|
| 2005 |
Grossman JC, Mitas L. Efficient quantum monte carlo energies for molecular dynamics simulations. Physical Review Letters. 94: 056403. PMID 15783668 DOI: 10.1103/Physrevlett.94.056403 |
0.633 |
|
| 2004 |
Prendergast D, Grossman JC, Williamson AJ, Fattebert JL, Galli G. Optical properties of silicon clusters in the presence of water: a first principles theoretical analysis. Journal of the American Chemical Society. 126: 13827-37. PMID 15493943 DOI: 10.1021/Ja048038P |
0.333 |
|
| 2004 |
Draeger EW, Grossman JC, Williamson AJ, Galli G. Optical properties of passivated silicon nanoclusters: the role of synthesis. The Journal of Chemical Physics. 120: 10807-14. PMID 15268108 DOI: 10.1063/1.1738633 |
0.68 |
|
| 2004 |
Grossman JC, Schwegler E, Draeger EW, Gygi F, Galli G. Towards an assessment of the accuracy of density functional theory for first principles simulations of water. The Journal of Chemical Physics. 120: 300-11. PMID 15267290 DOI: 10.1063/1.1630560 |
0.66 |
|
| 2003 |
Draeger EW, Grossman JC, Williamson AJ, Galli G. Influence of synthesis conditions on the structural and optical properties of passivated silicon nanoclusters. Physical Review Letters. 90: 167402. PMID 12732006 DOI: 10.1103/Physrevlett.90.167402 |
0.673 |
|
| 2003 |
Puzder A, Williamson AJ, Grossman JC, Galli G. Computational studies of the optical emission of silicon nanocrystals. Journal of the American Chemical Society. 125: 2786-91. PMID 12603167 DOI: 10.1021/Ja0293296 |
0.303 |
|
| 2003 |
Benedict LX, Puzder A, Williamson AJ, Grossman JC, Galli G, Klepeis JE, Raty JY, Pankratov O. Calculation of optical absorption spectra of hydrogenated Si clusters: Bethe-Salpeter equation versus time-dependent local-density approximation Physical Review B - Condensed Matter and Materials Physics. 68: 853101-853108. DOI: 10.1103/Physrevb.68.085310 |
0.312 |
|
| 2003 |
Draeger EW, Grossman JC, Williamson AJ, Galli G. Synthesis dynamics of passivated silicon nanoclusters Physica Status Solidi (B) Basic Research. 239: 11-18. DOI: 10.1002/Pssb.200303232 |
0.676 |
|
| 2002 |
Williamson AJ, Grossman JC, Hood RQ, Puzder A, Galli G. Quantum Monte Carlo calculations of nanostructure optical gaps: application to silicon quantum dots. Physical Review Letters. 89: 196803. PMID 12443140 DOI: 10.1103/Physrevlett.89.196803 |
0.304 |
|
| 2002 |
Puzder A, Williamson AJ, Grossman JC, Galli G. Surface chemistry of silicon nanoclusters. Physical Review Letters. 88: 097401. PMID 11864049 DOI: 10.1103/Physrevlett.88.097401 |
0.307 |
|
| 2002 |
Puzder A, Williamson AJ, Grossman JC, Galli G. Surface control of optical properties in silicon nanoclusters Journal of Chemical Physics. 117: 6721-6729. DOI: 10.1063/1.1504707 |
0.3 |
|
| 2002 |
Puzder A, Williamson AJ, Grossman JC, Galli G. Passivation effects of silicon nanoclusters Materials Science and Engineering B: Solid-State Materials For Advanced Technology. 96: 80-85. DOI: 10.1016/S0921-5107(02)00295-7 |
0.329 |
|
| 2002 |
Grossman JC, Colvin ME, Tran NL, Louie SG, Cohen ML. Aromaticity and hydrogenation patterns in highly strained fullerenes Chemical Physics Letters. 356: 247-253. DOI: 10.1016/S0009-2614(02)00307-X |
0.456 |
|
| 2002 |
Puzder A, Williamson AJ, Grossman JC, Galli G. Simulation of semiconductor nanostructures Physica Status Solidi (B) Basic Research. 233: 39-48. DOI: 10.1002/1521-3951(200209)233:1<39::Aid-Pssb39>3.0.Co;2-A |
0.329 |
|
| 2001 |
Williamson AJ, Hood RQ, Grossman JC. Linear-scaling quantum Monte Carlo calculations. Physical Review Letters. 87: 246406. PMID 11736525 DOI: 10.1103/Physrevlett.87.246406 |
0.328 |
|
| 2001 |
Grossman JC, Rohlfing M, Mitas L, Louie SG, Cohen ML. High accuracy many-body calculational approaches for excitations in molecules. Physical Review Letters. 86: 472-5. PMID 11177858 DOI: 10.1103/Physrevlett.86.472 |
0.668 |
|
| 2000 |
Mitas L, Grossman JC, Stich I, Tobik J. Silicon clusters of intermediate size: energetics, dynamics, and thermal effects Physical Review Letters. 84: 1479-82. PMID 11017547 DOI: 10.1103/Physrevlett.84.1479 |
0.637 |
|
| 2000 |
Grossman JC, Lester WA, Louie SG. Quantum monte carlo and density functional theory characterization of 2- cyclopentenone and 3-cyclopentenone formation from O(3P) + cyclopentadiene Journal of the American Chemical Society. 122: 705-711. DOI: 10.1021/Ja983879F |
0.464 |
|
| 1999 |
Collins PG, Grossman JC, Côté M, Ishigami M, Piskoti C, Louie SG, Cohen ML, Zettl A. Scanning Tunneling Spectroscopy ofC36 Physical Review Letters. 82: 165-168. DOI: 10.1103/Physrevlett.82.165 |
0.469 |
|
| 1999 |
Grossman JC, Louie SG, Cohen ML. SolidC36:Crystal structures, formation, and effects of doping Physical Review B. 60: R6941-R6944. DOI: 10.1103/Physrevb.60.R6941 |
0.439 |
|
| 1999 |
Grossman JC, Mizel A, Côté M, Cohen ML, Louie SG. Transition metals and their carbides and nitrides: Trends in electronic and structural properties Physical Review B. 60: 6343-6347. DOI: 10.1103/Physrevb.60.6343 |
0.486 |
|
| 1999 |
Grossman JC, Lester WA, Louie SG. Cyclopentadiene stability: Quantum Monte Carlo, coupled cluster, and density functional theory determinations Molecular Physics. 96: 629-632. DOI: 10.1080/00268979909482999 |
0.483 |
|
| 1998 |
Côté M, Grossman JC, Cohen ML, Louie SG. Electron-Phonon Interactions in SolidC36 Physical Review Letters. 81: 697-700. DOI: 10.1103/Physrevlett.81.697 |
0.485 |
|
| 1998 |
Côté M, Grossman JC, Cohen ML, Louie SG. Theoretical study of a three-dimensional all-sp2structure Physical Review B. 58: 664-668. DOI: 10.1103/Physrevb.58.664 |
0.463 |
|
| 1998 |
Grossman JC, Côté M, Louie SG, Cohen ML. Electronic and structural properties of molecular C36 Chemical Physics Letters. 284: 344-349. DOI: 10.1016/S0009-2614(97)01433-4 |
0.51 |
|
| 1997 |
Grossman JC, Mitas L. High accuracy molecular heats of formation and reaction barriers: Essential role of electron correlation Physical Review Letters. 79: 4353-4356. DOI: 10.1103/Physrevlett.79.4353 |
0.607 |
|
| 1996 |
Grossman JC, Mitas L, Raghavachari K. Structure and Stability of Molecular Carbon: Importance of Electron Correlation [Phys. Rev. Lett. 75, 3870 (1995)] Physical Review Letters. 76: 1006. DOI: 10.1103/Physrevlett.76.1006 |
0.604 |
|
| 1995 |
Grossman JC, Mitas L, Raghavachari K. Structure and stability of molecular carbon: Importance of electron correlation. Physical Review Letters. 75: 3870-3873. PMID 10059752 DOI: 10.1103/Physrevlett.75.3870 |
0.621 |
|
| 1995 |
Grossman JC, Mitás L. Quantum Monte Carlo determination of electronic and structural properties of Sin clusters (n <= 20). Physical Review Letters. 74: 1323-1326. PMID 10058991 DOI: 10.1103/Physrevlett.74.1323 |
0.6 |
|
| 1995 |
Grossman JC, Mitás L. Family of low-energy elongated Sin (n <= 50) clusters. Physical Review. B, Condensed Matter. 52: 16735-16738. PMID 9981077 DOI: 10.1103/Physrevb.52.16735 |
0.569 |
|
| 1990 |
Freeman AJ, Continenza A, Massidda S, Grossman JC. Structural and electronic properties and possible superconductivity in simple cubic Fe Physica C: Superconductivity and Its Applications. 166: 317-322. DOI: 10.1016/0921-4534(90)90411-7 |
0.31 |
|
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