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Top Articles

#TitleJournalYearCitations
1Projector augmented-wave methodPhysical Review B199485,455
2General atomic and molecular electronic structure systemJournal of Computational Chemistry199317,976
3Contracted Gaussian basis sets for molecular calculations. I. Second row atoms, Z=11–18Journal of Chemical Physics19809,126
4The use of fast Fourier transform for the estimation of power spectra: A method based on time averaging over short, modified periodogramsIEEE Transactions on Audio and Electroacoustics19677,566
5Improved tetrahedron method for Brillouin-zone integrationsPhysical Review B19946,678
6Quantum computation with quantum dotsPhysical Review A19985,516
7Current-driven excitation of magnetic multilayersJournal of Magnetism and Magnetic Materials19965,442
8Roothaan-Hartree-Fock atomic wavefunctionsAtomic Data and Nuclear Data Tables19745,011
9Organic Thin Film Transistors for Large Area ElectronicsAdvanced Materials20024,265
10Communication via one- and two-particle operators on Einstein-Podolsky-Rosen statesPhysical Review Letters19924,106
11Mixed-state entanglement and quantum error correctionPhysical Review A19963,972
12CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculationsJournal of Chemical Physics20203,816
13The work function of the elements and its periodicityJournal of Applied Physics19773,742
14Modeling solid-state chemistry: Interatomic potentials for multicomponent systemsPhysical Review B19893,558
15Synthesis and Characterization of Monodisperse Nanocrystals and Close-Packed Nanocrystal AssembliesAnnual Review of Materials Research20003,368
16Gaussian Basis Set for Molecular Wavefunctions Containing Third‐Row AtomsJournal of Chemical Physics19703,160
17Storage of hydrogen in single-walled carbon nanotubesNature19973,031
18Boson localization and the superfluid-insulator transitionPhysical Review B19892,988
19Cobalt-catalysed growth of carbon nanotubes with single-atomic-layer wallsNature19932,696
20The Design and Implementation of FFTW3Proceedings of the IEEE20052,696
21Giant tunnelling magnetoresistance at room temperature with MgO (100) tunnel barriersNature Materials20042,682
22Modeling by shortest data descriptionAutomatica19782,658
23Electronics using hybrid-molecular and mono-molecular devicesNature20002,575
24A relational model of data for large shared data banksCommunications of the ACM19702,437
25Concentrating partial entanglement by local operationsPhysical Review A19962,398
26Purification of Noisy Entanglement and Faithful Teleportation via Noisy ChannelsPhysical Review Letters19962,295
27Optimized pseudopotentialsPhysical Review B19902,290
28Exact Analysis of an Interacting Bose Gas. I. The General Solution and the Ground StatePhysical Review19632,181
29Superconductivity in a layered perovskite without copperNature19942,167
30Positioning single atoms with a scanning tunnelling microscopeNature19902,146
31Coding In-depth Semistructured InterviewsSociological Methods and Research20132,111
32Optimal decoding of linear codes for minimizing symbol error rate (Corresp.)IEEE Transactions on Information Theory19742,079
33Tunnel field-effect transistors as energy-efficient electronic switchesNature20112,043
34Single- and multi-wall carbon nanotube field-effect transistorsApplied Physics Letters19982,028
35Atomic Screening Constants from SCF FunctionsJournal of Chemical Physics19632,027
36Quantum information and computationNature20001,996
37Quantum cryptography using any two nonorthogonal statesPhysical Review Letters19921,976
38Quantum cryptography: Public key distribution and coin tossingTheoretical Computer Science20141,957
39L-Moments: Analysis and Estimation of Distributions Using Linear Combinations of Order StatisticsJournal of the Royal Statistical Society Series B: Statistical Methodology19901,900
40Frequency modulation detection using high‐Qcantilevers for enhanced force microscope sensitivityJournal of Applied Physics19911,887
41AI4People—An Ethical Framework for a Good AI Society: Opportunities, Risks, Principles, and RecommendationsMinds and Machines20181,864
42Emerging challenges and materials for thermal management of electronicsMaterials Today20141,831
43What is "liquid"? Understanding the states of matterReviews of Modern Physics19761,802
44Structural diversity in binary nanoparticle superlatticesNature20061,797
45Band lineups and deformation potentials in the model-solid theoryPhysical Review B19891,785
46Quantum cryptography without Bell’s theoremPhysical Review Letters19921,738
47Chemical recycling of waste plastics for new materials productionNature Reviews Chemistry20171,696
48Empirical Interatomic Potential for Carbon, with Applications to Amorphous CarbonPhysical Review Letters19881,634
49Memory devices and applications for in-memory computingNature Nanotechnology20201,626
50Microscopic structure of theSiO2/Si interfacePhysical Review B19881,625