Shiv N. Khanna - Publications

Affiliations: 
Chemistry Virginia Commonwealth University, Richmond, VA, United States 
Area:
Atomic Physics, Physical Chemistry

327 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
2022 Reber AC, Sengupta T, Bista D, Khanna SN. Magic Numbers in Octahedral Ligated Metal-Chalcogenide Superatoms. Inorganic Chemistry. 61: 16003-16008. PMID 36149274 DOI: 10.1021/acs.inorgchem.2c02361  0.701
2022 Sengupta T, Khanna SN. Rational Design of Bimetallic Metal Chalcogenide Clusters for CO Dissociation. The Journal of Physical Chemistry. A. 126: 5702-5710. PMID 35973159 DOI: 10.1021/acs.jpca.2c03560  0.376
2022 Biswas S, Das AK, Reber AC, Biswas S, Bhandary S, Kamble VB, Khanna SN, Mandal S. The New Ag-S Cluster [AgS(SBu)][CFCOO] with a Unique hcp Ag Kernel and Ag Keplerian-Shell-Based Structural Architecture and Its Photoresponsivity. Nano Letters. PMID 35499472 DOI: 10.1021/acs.nanolett.2c00609  0.6
2022 Bista D, Aydt AP, Anderton KJ, Paley DW, Betley TA, Reber AC, Chauhan V, Bartholomew AK, Roy X, Khanna SN. High-Spin Superatom Stabilized by Dual Subshell Filling. Journal of the American Chemical Society. 144: 5172-5179. PMID 35289175 DOI: 10.1021/jacs.2c00731  0.737
2021 Shen J, He H, Sengupta T, Bista D, Reber AC, Pandey R, Khanna SN. Electron transport properties of PAl-based cluster complexes. Nanoscale Advances. 3: 6888-6896. PMID 36132360 DOI: 10.1039/d1na00355k  0.706
2021 Bista D, Sengupta T, Khanna SN. Massive dipoles across the metal-semiconductor cluster interface: towards chemically controlled rectification. Physical Chemistry Chemical Physics : Pccp. 23: 18975-18982. PMID 34612436 DOI: 10.1039/d1cp02420e  0.492
2021 Khanna SN, Reber AC, Bista D, Sengupta T, Lambert R. The superatomic state beyond conventional magic numbers: Ligated metal chalcogenide superatoms. The Journal of Chemical Physics. 155: 120901. PMID 34598575 DOI: 10.1063/5.0062582  0.735
2021 Bista D, Sengupta T, Reber AC, Khanna SN. Interfacial magnetism in a fused superatomic cluster [CoSe(PEt)]. Nanoscale. PMID 34528648 DOI: 10.1039/d1nr00876e  0.697
2021 Das AK, Maity S, Sengupta T, Bista D, Reber AC, Patra A, Khanna SN, Mandal S. One-Dimensional Silver-Thiolate Cluster-Assembly: Effect of Argentophilic Interactions on Excited-State Dynamics. The Journal of Physical Chemistry Letters. 2154-2159. PMID 33626284 DOI: 10.1021/acs.jpclett.0c03728  0.735
2021 Bista D, Sengupta T, Reber AC, Khanna SN. A Magnetic Superatomic Dimer with an Intense Internal Electric Dipole Moment. The Journal of Physical Chemistry. A. PMID 33443425 DOI: 10.1021/acs.jpca.0c10262  0.707
2020 Anumula R, Reber AC, An P, Cui C, Guo M, Wu H, Luo Z, Khanna SN. Ligand accommodation causes the anti-centrosymmetric structure of AuCu clusters with near-infrared emission. Nanoscale. PMID 32627782 DOI: 10.1039/D0Nr02448A  0.691
2020 Bista D, Chauhan V, Sengupta T, Reber AC, Khanna SN. A ligand-induced homojunction between aluminum-based superatomic clusters. Nanoscale. PMID 32469025 DOI: 10.1039/D0Nr02611E  0.763
2020 Reber AC, Chauhan V, Bista D, Khanna SN. Superatomic molecules with internal electric fields for light harvesting. Nanoscale. PMID 32049078 DOI: 10.1039/C9Nr09229C  0.745
2019 Armstrong A, Zhang H, Reber AC, Jia Y, Wu H, Luo Z, Khanna SN. Al Valence Controls the Coordination and Stability of Cationic Aluminum-Oxygen Clusters in Reactions of Al with Oxygen. The Journal of Physical Chemistry. A. PMID 31386364 DOI: 10.1021/Acs.Jpca.9B05646  0.736
2019 Armstrong A, Reber AC, Khanna SN. Multiple Valence Aluminum and the Electronic and Geometric Structure of AlO Clusters. The Journal of Physical Chemistry. A. PMID 31146532 DOI: 10.1021/Acs.Jpca.9B01729  0.76
2019 Liu G, Pinkard A, Ciborowski SM, Chauhan V, Zhu Z, Aydt AP, Khanna SN, Roy X, Bowen KH. Tuning the electronic properties of hexanuclear cobalt sulfide superatoms ligand substitution. Chemical Science. 10: 1760-1766. PMID 30842842 DOI: 10.1039/C8Sc03862G  0.521
2019 Zhang H, Reber AC, Geng L, Rabayda D, Wu H, Luo Z, Yao J, Khanna SN. Formation of Al + (C 6 H 6 ) 13 : The Origin of Magic Number in Metal–Benzene Clusters Determined by the Nature of the Core Ccs Chemistry. 1: 571-581. DOI: 10.31635/ccschem.019.20190033  0.652
2019 Liu G, Chauhan V, Aydt AP, Ciborowski SM, Pinkard A, Zhu Z, Roy X, Khanna SN, Bowen KH. Ligand Effect on the Electronic Structure of Cobalt Sulfide Clusters: A Combined Experimental and Theoretical Study The Journal of Physical Chemistry C. 123: 25121-25127. DOI: 10.1021/Acs.Jpcc.9B04153  0.555
2019 Reber AC, Bista D, Chauhan V, Khanna SN. Transforming Redox Properties of Clusters Using Phosphine Ligands The Journal of Physical Chemistry C. 123: 8983-8989. DOI: 10.1021/Acs.Jpcc.9B00039  0.685
2019 Prabha S, Reber AC, Khanna SN. The structure and stability of CrnTem (1 ≤ n ≤ 6, 1 ≤ m ≤ 8) clusters Chemical Physics Letters. 720: 76-82. DOI: 10.1016/J.Cplett.2019.02.003  0.752
2018 Jash M, Reber AC, Ghosh A, Sarkar D, Bodiuzzaman M, Basuri P, Baksi A, Khanna SN, Pradeep T. Preparation of gas phase naked silver cluster cations outside a mass spectrometer from ligand protected clusters in solution. Nanoscale. PMID 30094450 DOI: 10.1039/C8Nr04146F  0.743
2018 Chauhan V, Khanna SN. Strong Effect of Organic Ligands on the Electronic Structure of Metal-Chalcogenide Clusters. The Journal of Physical Chemistry. A. PMID 29953818 DOI: 10.1021/Acs.Jpca.8B03355  0.525
2018 Chauhan V, Reber AC, Khanna SN. Strong lowering of ionization energy of metallic clusters by organic ligands without changing shell filling. Nature Communications. 9: 2357. PMID 29907744 DOI: 10.1038/S41467-018-04799-0  0.748
2018 Reber AC, Khanna SN. The effect of chalcogen and metal on the electronic properties and stability of metal–chalcogenides clusters, TM6Xn(PH3)6 (TM = Mo, Cr, Re, Co, Ni; X = Se, Te; n = 8,5) The European Physical Journal D. 72. DOI: 10.1140/Epjd/E2018-90223-7  0.734
2018 Reber AC, Khanna SN. Co6Se8(PEt3)6 superatoms as tunable chemical dopants for two-dimensional semiconductors Npj Computational Materials. 4. DOI: 10.1038/s41524-018-0092-9  0.509
2018 Yang Y, Reber AC, Gilliland SE, Castano CE, Gupton BF, Khanna SN. Donor/Acceptor Concepts for Developing Efficient Suzuki Cross-Coupling Catalysts Using Graphene-Supported Ni, Cu, Fe, Pd, and Bimetallic Pd/Ni Clusters The Journal of Physical Chemistry C. 122: 25396-25403. DOI: 10.1021/Acs.Jpcc.8B07538  0.716
2018 Kane KA, Reber AC, Khanna SN, Bertino MF. Laser synthesized nanoparticle alloys of metals with bulk miscibility gaps Progress in Natural Science: Materials International. 28: 456-463. DOI: 10.1016/J.Pnsc.2018.05.001  0.628
2018 Yang Y, Reber AC, Gilliland SE, Castano CE, Gupton BF, Khanna SN. More than just a support: Graphene as a solid-state ligand for palladium-catalyzed cross-coupling reactions Journal of Catalysis. 360: 20-26. DOI: 10.1016/J.Jcat.2018.01.027  0.584
2018 Bista D, Reber AC, Chauhan V, Khanna SN. Electronic and magnetic properties of Fe2Sin (1 ≤ n ≤ 12)+/0/− clusters Chemical Physics Letters. 706: 113-119. DOI: 10.1016/J.Cplett.2018.05.079  0.638
2017 Chauhan V, Reber AC, Khanna SN. CO ligands stabilize metal chalcogenide Co6Se8(CO)n clusters via demagnetization. Physical Chemistry Chemical Physics : Pccp. 19: 31940-31948. PMID 29211076 DOI: 10.1039/C7Cp07606A  0.751
2017 Khanna SN, Reber AC. Superatomic solids: Intercalation without altercation. Nature Chemistry. 9: 1151-1152. PMID 29168487 DOI: 10.1038/Nchem.2895  0.716
2017 Grover CJ, Reber AC, Khanna SN. Ionic versus metallic bonding in AlnNam and AlnMgm (m ≤ 3, n + m ≤ 15) clusters. The Journal of Chemical Physics. 146: 224301. PMID 29166082 DOI: 10.1063/1.4985093  0.726
2017 Biltek SR, Reber AC, Khanna SN, Sen A. The Complete Ag4M2(DMSA)4 (M = Ni, Pd, Pt, DMSA = Dimercaptosuccinic Acid) Cluster Series: Optical Properties, Stability, and Structural Characterization. The Journal of Physical Chemistry. A. PMID 28657753 DOI: 10.1021/Acs.Jpca.7B04669  0.652
2017 Blades WH, Reber AC, Khanna SN, Lopez-Sosa L, Calaminici P, Koster AM. Evolution of the Spin Magnetic Moments and Atomic Valence of Vanadium in VCux(+), VAgx(+), and VAux(+) Clusters (x = 3 - 14). The Journal of Physical Chemistry. A. PMID 28350450 DOI: 10.1021/Acs.Jpca.7B01030  0.741
2017 Reber AC, Khanna SN. Superatoms: Electronic and Geometric Effects on Reactivity. Accounts of Chemical Research. PMID 28182404 DOI: 10.1021/Acs.Accounts.6B00464  0.775
2017 Reber AC, Chauhan V, Khanna SN. Symmetry and magnetism in Ni9Te6 clusters ligated by CO or phosphine ligands. The Journal of Chemical Physics. 146: 024302. PMID 28088159 DOI: 10.1063/1.4973609  0.72
2017 Chauhan V, Reber AC, Khanna SN. Metal Chalcogenide Clusters with Closed Electronic Shells and the Electronic Properties of Alkalis and Halogens. Journal of the American Chemical Society. PMID 28081603 DOI: 10.1021/Jacs.6B09416  0.735
2017 Asha KS, Reber AC, Ahmed N, Nath R, Khanna SN, Mandal S. The effect of substituted benzene dicarboxylic acid linkers on the optical band gap energy and magnetic coupling in manganese trimer metal organic frameworks Journal of Materials Chemistry C. 5: 539-548. DOI: 10.1039/C6Tc03577A  0.6
2017 Reber AC, Khanna SN. Effect of Embedding Platinum Clusters in Alumina on Sintering, Coking, and Activity The Journal of Physical Chemistry C. 121: 21527-21534. DOI: 10.1021/Acs.Jpcc.7B07452  0.719
2016 Luo Z, Reber AC, Jia M, Blades WH, Khanna SN, Castleman AW. What determines if a ligand activates or passivates a superatom cluster? Chemical Science. 7: 3067-3074. PMID 29997798 DOI: 10.1039/C5Sc04293C  0.759
2016 Luo Z, Castleman AW, Khanna SN. Reactivity of Metal Clusters. Chemical Reviews. 116: 14456-14492. PMID 27960263 DOI: 10.1021/Acs.Chemrev.6B00230  0.524
2016 Yang Y, Castano CE, Gupton BF, Reber AC, Khanna SN. A fundamental analysis of enhanced cross-coupling catalytic activity for palladium clusters on graphene supports. Nanoscale. PMID 27833943 DOI: 10.1039/C6Nr06793J  0.642
2016 Sutradhar P, Chauhan V, Khanna SN, Atulasimha J. Magnetic behavior of superatomic-fullerene assemblies. Physical Chemistry Chemical Physics : Pccp. PMID 27711583 DOI: 10.1039/C6Cp05196K  0.332
2016 Chauhan V, Reber AC, Khanna SN. Transforming Ni9Te6 from Electron Donor to Acceptor via Ligand Exchange. The Journal of Physical Chemistry. A. PMID 27494164 DOI: 10.1021/Acs.Jpca.6B05701  0.722
2016 Tomalia DA, Khanna SN. A Systematic Framework and Nanoperiodic Concept for Unifying Nanoscience: Hard/Soft Nanoelements, Superatoms, Meta-Atoms, New Emerging Properties, Periodic Property Patterns, and Predictive Mendeleev-like Nanoperiodic Tables. Chemical Reviews. PMID 26821999 DOI: 10.1021/Acs.Chemrev.5B00367  0.313
2016 Chauhan V, Sahoo S, Khanna SN. Ni9Te6(PEt3)8C60 Is a Superatomic Superalkali Superparamagnetic Cluster Assembled Material (S(3)-CAM). Journal of the American Chemical Society. 138: 1916-21. PMID 26789076 DOI: 10.1021/Jacs.5B10986  0.46
2016 Chauhan V, Sahoo S, Khanna SN. Ni9Te6(PEt3)8C60 Is a Superatomic Superalkali Superparamagnetic Cluster Assembled Material (S3-CAM) Journal of the American Chemical Society. 138: 1916-1921. DOI: 10.1021/jacs.5b10986  0.301
2016 Reber AC, Khanna SN, Roberts FS, Anderson SL. Effect of O2 and CO Exposure on the Photoelectron Spectroscopy of Size-Selected Pdn Clusters Supported on TiO2(110) Journal of Physical Chemistry C. 120: 2126-2138. DOI: 10.1021/Acs.Jpcc.5B08611  0.739
2016 Sahoo S, Reber AC, Khanna SN. Effect of location and filling of d-states on methane activation in single site Fe-based catalysts Chemical Physics Letters. 660: 48-54. DOI: 10.1016/J.Cplett.2016.07.053  0.637
2015 Sahoo S, Reber AC, Khanna SN. A Conceptual Basis for Understanding C-C Bond Activation in Ethane by Second Row Transition Metal Carbides. The Journal of Physical Chemistry. A. PMID 26616749 DOI: 10.1021/Acs.Jpca.5B09567  0.625
2015 George A, Asha KS, Reber AC, Biltek SR, Pedicini AF, Sen A, Khanna SN, Mandal S. Atom precise platinum-thiol crowns. Nanoscale. PMID 26486562 DOI: 10.1039/C5Nr05325K  0.713
2015 Abreu MB, Reber AC, Khanna SN. Making sense of the conflicting magic numbers in WSi(n) clusters. The Journal of Chemical Physics. 143: 074310. PMID 26298137 DOI: 10.1063/1.4928755  0.756
2015 Chauhan V, Abreu MB, Reber AC, Khanna SN. Geometry controls the stability of FeSi14. Physical Chemistry Chemical Physics : Pccp. 17: 15718-24. PMID 26013325 DOI: 10.1039/C5Cp01386K  0.707
2015 Reber AC, Khanna SN. Electronic structure, stability, and oxidation of boron-magnesium clusters and cluster solids. The Journal of Chemical Physics. 142: 054304. PMID 25662642 DOI: 10.1063/1.4907273  0.778
2015 Van Dijk CN, Roy DR, Fielicke A, Rasing T, Reber AC, Khanna SN, Kirilyuk A. Structure investigation of CoxO y + (x=3-6, y=3-8) clusters by IR vibrational spectroscopy and DFT calculations European Physical Journal D. 68. DOI: 10.1140/Epjd/E2014-50503-X  0.733
2015 Sahoo S, Islam MF, Khanna SN. Using graphene to control magnetic anisotropy and interaction between supported clusters New Journal of Physics. 17. DOI: 10.1088/1367-2630/17/5/053052  0.494
2015 Sahoo S, Khanna SN, Entel P. Controlling the magnetic anisotropy of Ni cluster supported on graphene flakes with topological defects Applied Physics Letters. 107. DOI: 10.1063/1.4927480  0.43
2015 El-Gendy AA, Bertino M, Clifford D, Qian M, Khanna SN, Carpenter EE. Experimental evidence for the formation of CoFe2C phase with colossal magnetocrystalline-anisotropy Applied Physics Letters. 106. DOI: 10.1063/1.4921789  0.311
2015 Chauhan V, Abreu MB, Reber AC, Khanna SN. Geometry controls the stability of FeSi14 Physical Chemistry Chemical Physics. 17: 15718-15724. DOI: 10.1039/c5cp01386k  0.534
2015 Roberts FS, Anderson SL, Reber AC, Khanna SN. Initial and final state effects in the ultraviolet and X-ray photoelectron spectroscopy (UPS and XPS) of size-selected Pdn clusters supported on TiO2(110) Journal of Physical Chemistry C. 119: 6033-6046. DOI: 10.1021/Jp512263W  0.71
2015 Asha KS, Reber AC, Pedicini AF, Khanna SN, Mandal S. The effects of alkaline-earth counterions on the architectures, band-gap energies, and proton transfer of triazole-based coordination polymers European Journal of Inorganic Chemistry. 2015: 2085-2091. DOI: 10.1002/Ejic.201403162  0.596
2014 Abreu MB, Reber AC, Khanna SN. Does the 18-Electron Rule Apply to CrSi12? The Journal of Physical Chemistry Letters. 5: 3492-6. PMID 26278598 DOI: 10.1021/Jz501868T  0.74
2014 Sahoo S, Gruner ME, Khanna SN, Entel P. First-principles studies on graphene-supported transition metal clusters. The Journal of Chemical Physics. 141: 074707. PMID 25149806 DOI: 10.1063/1.4893328  0.433
2014 Luo Z, Gamboa GU, Jia M, Reber AC, Khanna SN, Castleman AW. Reactivity of silver clusters anions with ethanethiol. The Journal of Physical Chemistry. A. 118: 8345-50. PMID 24869921 DOI: 10.1021/Jp501164G  0.688
2014 Medel VM, Reber AC, Chauhan V, Sen P, Köster AM, Calaminici P, Khanna SN. Nature of valence transition and spin moment in Ag(n)V(+) clusters. Journal of the American Chemical Society. 136: 8229-36. PMID 24824084 DOI: 10.1021/Ja412064C  0.712
2014 Biltek SR, Sen A, Pedicini AF, Reber AC, Khanna SN. Isolation and structural characterization of a silver-platinum nanocluster, Ag4Pt2(DMSA)4. The Journal of Physical Chemistry. A. 118: 8314-9. PMID 24749736 DOI: 10.1021/Jp501124Q  0.717
2014 Smith JC, Reber AC, Khanna SN, Castleman AW. Boron substitution in aluminum cluster anions: magic clusters and reactivity with oxygen. The Journal of Physical Chemistry. A. 118: 8485-92. PMID 24725222 DOI: 10.1021/Jp501934T  0.774
2014 Islam MF, Khanna SN. On the enhancement of magnetic anisotropy in cobalt clusters via non-magnetic doping. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 26: 125303. PMID 24599083 DOI: 10.1088/0953-8984/26/12/125303  0.504
2014 Fhokrul Islam M, Khanna SN. Stable magnetic order and charge induced rotation of magnetization in nano-clusters Applied Physics Letters. 105. DOI: 10.1063/1.4898670  0.406
2014 Reber AC, Khanna SN. Effect of N- and P-type doping on the oxygen-binding energy and oxygen spillover of supported palladium clusters Journal of Physical Chemistry C. 118: 20306-20313. DOI: 10.1021/Jp5045145  0.647
2013 Pedicini AF, Reber AC, Khanna SN. The effect of sulfur covalent bonding on the electronic shells of silver clusters. The Journal of Chemical Physics. 139: 164317. PMID 24182039 DOI: 10.1063/1.4827091  0.757
2013 Zhu L, Qian M, Khanna SN. Unusually large spin polarization and magnetoresistance in a FeMg8-FeMg8 superatomic dimer. The Journal of Chemical Physics. 139: 064306. PMID 23947854 DOI: 10.1063/1.4817335  0.406
2013 Mandal S, Reber AC, Qian M, Weiss PS, Khanna SN, Sen A. Controlling the band gap energy of cluster-assembled materials. Accounts of Chemical Research. 46: 2385-95. PMID 23734558 DOI: 10.1021/Ar3002975  0.696
2013 Medel VM, Reveles JU, Islam MF, Khanna SN. Robust magnetic moments on impurities in metallic clusters: localized magnetic states in superatoms. The Journal of Physical Chemistry. A. 117: 4297-303. PMID 23611250 DOI: 10.1021/Jp4012735  0.503
2013 Zhang X, Wang Y, Wang H, Lim A, Gantefoer G, Bowen KH, Reveles JU, Khanna SN. On the existence of designer magnetic superatoms. Journal of the American Chemical Society. 135: 4856-61. PMID 23458600 DOI: 10.1021/Ja400830Z  0.484
2013 Luo Z, Grover CJ, Reber AC, Khanna SN, Castleman AW. Probing the magic numbers of aluminum-magnesium cluster anions and their reactivity toward oxygen. Journal of the American Chemical Society. 135: 4307-13. PMID 23432202 DOI: 10.1021/Ja310467N  0.734
2013 Biltek SR, Mandal S, Sen A, Reber AC, Pedicini AF, Khanna SN. Synthesis and structural characterization of an atom-precise bimetallic nanocluster, Ag4Ni2(DMSA)4. Journal of the American Chemical Society. 135: 26-9. PMID 23237531 DOI: 10.1021/Ja308884S  0.713
2013 Reber AC, Gamboa GU, Khanna SN. The oblate structure and unexpected resistance in reactivity of Ag 15 + with O2 Journal of Physics: Conference Series. 438. DOI: 10.1088/1742-6596/438/1/012002  0.529
2013 Qian M, Khanna SN. Magnetic properties of Co2-xTMxC and Co 3-xTMxC nanoparticles Journal of Applied Physics. 114. DOI: 10.1063/1.4858391  0.333
2013 Gamboa GU, Reber AC, Khanna SN. Electronic subshell splitting controls the atomic structure of charged and neutral silver clusters New Journal of Chemistry. 37: 3928-3935. DOI: 10.1039/C3Nj01075A  0.773
2013 Woodward WH, Reber AC, Smith JC, Khanna SN, Castleman AW. Carbonyl bond cleavage by complementary active sites Journal of Physical Chemistry C. 117: 7445-7450. DOI: 10.1021/Jp303668B  0.671
2012 Abreu MB, Powell C, Reber AC, Khanna SN. Ligand-induced active sites: reactivity of iodine-protected aluminum superatoms with methanol. Journal of the American Chemical Society. 134: 20507-12. PMID 23181773 DOI: 10.1021/Ja309473S  0.75
2012 Zhu L, Khanna SN. Quantum spin transport through magnetic superatom dimer (Cs8V-Cs8V). The Journal of Chemical Physics. 137: 164311. PMID 23126714 DOI: 10.1063/1.4763461  0.318
2012 Luo Z, Gamboa GU, Smith JC, Reber AC, Reveles JU, Khanna SN, Castleman AW. Spin accommodation and reactivity of silver clusters with oxygen: the enhanced stability of Ag13(-). Journal of the American Chemical Society. 134: 18973-8. PMID 23113750 DOI: 10.1021/Ja303268W  0.745
2012 Mandal S, Reber AC, Qian M, Liu R, Saavedra HM, Sen S, Weiss PS, Khanna SN, Sen A. Synthesis, structure and band gap energy of covalently linked cluster-assembled materials. Dalton Transactions (Cambridge, England : 2003). 41: 12365-77. PMID 22940817 DOI: 10.1039/C2Dt31286G  0.708
2012 Reber AC, Roach PJ, Woodward WH, Khanna SN, Castleman AW. Edge-induced active sites enhance the reactivity of large aluminum cluster anions with alcohols. The Journal of Physical Chemistry. A. 116: 8085-91. PMID 22780221 DOI: 10.1021/Jp3047196  0.704
2012 Medel VM, Reber AC, Reveles JU, Khanna SN. Metallic and molecular orbital concepts in XMg8 clusters, X = Be-F. The Journal of Chemical Physics. 136: 134311. PMID 22482556 DOI: 10.1063/1.3700086  0.75
2012 Reveles JU, Köster AM, Calaminici P, Khanna SN. Structural changes of Pd13 upon charging and oxidation/reduction. The Journal of Chemical Physics. 136: 114505. PMID 22443775 DOI: 10.1063/1.3692612  0.366
2012 Mandal S, Reber AC, Qian M, Liu R, Saavedra HM, Sen S, Weiss PS, Khanna SN, Sen A. On the stability of an unsupported mercury-mercury bond linking group 15 Zintl clusters. Dalton Transactions (Cambridge, England : 2003). 41: 5454-7. PMID 22391573 DOI: 10.1039/C2Dt30083D  0.677
2012 Medel V, Reveles JU, Khanna SN. Magnetism of electrons in atoms and superatoms Journal of Applied Physics. 112. DOI: 10.1063/1.4752471  0.547
2012 Reber AC, Mandal S, Qian M, Saavedra HM, Weiss PS, Khanna SN, Sen A. Palladium in the gap: Cluster assemblies with band edges localized on linkers Journal of Physical Chemistry C. 116: 10207-10214. DOI: 10.1021/Jp301049E  0.723
2012 Ong SV, Khanna SN. Theoretical studies of the stability and oxidation of Pd n (n = 1-7) clusters on rutile TiO 2(110): Adsorption on the stoichiometric surface Journal of Physical Chemistry C. 116: 3105-3111. DOI: 10.1021/Jp212504X  0.831
2012 Ong SV, Khanna SN. Enhanced oxygen binding through surface mediated ionic bonds Surface Science. 606: 965-970. DOI: 10.1016/J.Susc.2012.02.015  0.803
2012 Chauhan V, Medel VM, Ulises Reveles J, Khanna SN, Sen P. Shell magnetism in transition metal doped calcium superatom Chemical Physics Letters. 528: 39-43. DOI: 10.1016/J.Cplett.2012.01.034  0.49
2011 Reber AC, Khanna SN, Tyo EC, Harmon CL, Castleman AW. Cooperative effects in the oxidation of CO by palladium oxide cations. The Journal of Chemical Physics. 135: 234303. PMID 22191871 DOI: 10.1063/1.3669428  0.624
2011 Köster AM, Calaminici P, Orgaz E, Roy DR, Reveles JU, Khanna SN. On the ground state of Pd13. Journal of the American Chemical Society. 133: 12192-6. PMID 21711047 DOI: 10.1021/Ja203889R  0.508
2011 Zheng WJ, Thomas OC, Nilles JM, Bowen KH, Reber AC, Khanna SN. Gas phase analogs of stable sodium-tin Zintl ions: anion photoelectron spectroscopy and electronic structure. The Journal of Chemical Physics. 134: 224307. PMID 21682514 DOI: 10.1063/1.3597604  0.724
2011 Medel VM, Reveles JU, Khanna SN, Chauhan V, Sen P, Castleman AW. Hund's rule in superatoms with transition metal impurities. Proceedings of the National Academy of Sciences of the United States of America. 108: 10062-6. PMID 21646542 DOI: 10.1073/Pnas.1100129108  0.503
2011 Mandal S, Liu R, Reber AC, Qian M, Saavedra HM, Ke X, Schiffer P, Sen S, Weiss PS, Khanna SN, Sen A. The Zintl ion [As7]2-: an example of an electron-deficient As(x) radical anion. Chemical Communications (Cambridge, England). 47: 3126-8. PMID 21267484 DOI: 10.1039/C0Cc03219K  0.647
2011 Medel VM, Reveles JU, Reber AC, Khanna SN, Castleman AW. Closed-shell to split-shell stability of isovalent clusters Physical Review B. 84. DOI: 10.1103/Physrevb.84.075435  0.733
2011 Mandal S, Qian M, Reber AC, Saavedra HM, Weiss PS, Khanna SN, Sen A. 3- M = Cr, Mo, W: Bonding and electronic structure of cluster assemblies with metal carbonyls Journal of Physical Chemistry C. 115: 23704-23710. DOI: 10.1021/Jp207268X  0.719
2011 Ong SV, Khanna SN. Origin of oxidation and support-induced structural changes in Pd 4 clusters supported on TiO 2 Journal of Physical Chemistry C. 115: 20217-20224. DOI: 10.1021/Jp2054603  0.819
2011 Tyo EC, Castleman AW, Reber AC, Khanna SN. Analogous reactivity of Pd + and ZrO +: Comparing the reactivity with small hydrocarbons Journal of Physical Chemistry C. 115: 16797-16802. DOI: 10.1021/Jp203740N  0.599
2011 Gupta U, Reber AC, Melko JJ, Khanna SN, Castleman A. Stability and electronic properties of isoelectronic heteroatomic analogs of Chemical Physics Letters. 505: 92-95. DOI: 10.1016/J.Cplett.2011.02.035  0.767
2010 Clayborne PA, Gupta U, Reber AC, Melko JJ, Khanna SN, Castleman AW. The applicability of three-dimensional aromaticity in BiSn(n)- Zintl analogues. The Journal of Chemical Physics. 133: 134302. PMID 20942534 DOI: 10.1063/1.3488103  0.855
2010 Chaki NK, Mandal S, Reber AC, Qian M, Saavedra HM, Weiss PS, Khanna SN, Sen A. Controlling band gap energies in cluster-assembled ionic solids through internal electric fields. Acs Nano. 4: 5813-8. PMID 20882982 DOI: 10.1021/Nn101640R  0.7
2010 Sobhy MA, Casalenuovo K, Reveles JU, Gupta U, Khanna SN, Castleman AW. Photoelectron imaging and density-functional investigation of bismuth and lead anions solvated in ammonia clusters. The Journal of Physical Chemistry. A. 114: 11353-63. PMID 20804193 DOI: 10.1021/Jp1058148  0.539
2010 Roy DR, Robles R, Khanna SN. Magnetic moment and local moment alignment in anionic and/or oxidized Fe(n) clusters. The Journal of Chemical Physics. 132: 194305. PMID 20499961 DOI: 10.1063/1.3425879  0.4
2010 Reber AC, Khanna SN, Roach PJ, Woodward WH, Castleman AW. Reactivity of aluminum cluster anions with water: origins of reactivity and mechanisms for H2 release. The Journal of Physical Chemistry. A. 114: 6071-81. PMID 20387861 DOI: 10.1021/Jp911136S  0.698
2010 Pradhan K, Reveles JU, Sen P, Khanna SN. Enhanced magnetic moments of alkali metal coated Sc clusters: new magnetic superatoms. The Journal of Chemical Physics. 132: 124302. PMID 20370118 DOI: 10.1063/1.3367722  0.512
2010 Melko JJ, Clayborne PA, Jones CE, Reveles JU, Gupta U, Khanna SN, Castleman AW. Combined experimental and theoretical study of Al(n)X (n = 1-6; X = As, Sb) clusters: evidence of aromaticity and the Jellium model. The Journal of Physical Chemistry. A. 114: 2045-52. PMID 20070095 DOI: 10.1021/Jp908406H  0.804
2010 Qian M, Reber AC, Ugrinov A, Chaki NK, Mandal S, Saavedra HM, Khanna SN, Sen A, Weiss PS. Cluster-assembled materials: toward nanomaterials with precise control over properties. Acs Nano. 4: 235-40. PMID 20038127 DOI: 10.1021/Nn9010297  0.756
2010 Clayborne PA, Jones CE, Gupta U, Melko JJ, Khanna SN, Castleman AW. Structural evolution of triniobium carbide clusters: evidence of large Cn chains (n = 3-4) in Nb3Cn- (n = 5-10) clusters. The Journal of Physical Chemistry. A. 114: 1290-7. PMID 19673506 DOI: 10.1021/Jp905022P  0.819
2010 Robles R, Khanna SN. Oxidation of Pdn (n=1-7, 10 ) clusters supported on alumina/NiAl(110) Physical Review B - Condensed Matter and Materials Physics. 82. DOI: 10.1103/Physrevb.82.085428  0.415
2010 Roach PJ, Woodward WH, Reber AC, Khanna SN, Castleman AW. Crystal field effects on the reactivity of aluminum-copper cluster anions Physical Review B - Condensed Matter and Materials Physics. 81. DOI: 10.1103/Physrevb.81.195404  0.678
2010 Melko JJ, Ong SV, Gupta U, Reveles JU, D'Emidio J, Khanna SN, Castleman AW. Anion photoelectron spectroscopy and first-principles study of Pb xIny clusters Journal of Physical Chemistry C. 114: 20907-20916. DOI: 10.1021/Jp1089432  0.837
2010 Reveles JU, Köster AM, Khanna SN, Quintanar C. Surface oxygen diffusion into neutral, cationic, and dicationic oxygen vacancies on MgO(100) surfaces Journal of Physical Chemistry C. 114: 12265-12270. DOI: 10.1021/Jp1040184  0.343
2010 Reveles JU, Sen P, Pradhan K, Roy DR, Khanna SN. Effect of Electronic and Geometric Shell Closures on the Stability of Neutral and Anionic TiNan (n = 1−13) Clusters The Journal of Physical Chemistry C. 114: 10739-10744. DOI: 10.1021/Jp101757N  0.545
2010 Gupta U, Reveles JU, Melko JJ, Khanna SN, Castleman AW. Origins of Stability in Mixed Bismuth−Indium Clusters The Journal of Physical Chemistry C. 114: 15963-15972. DOI: 10.1021/Jp1000754  0.54
2010 Melko JJ, Ong SV, Gupta U, Reveles JU, D'Emidio J, Khanna SN, Castleman AW. Resilient aromaticity in lead-indium clusters Chemical Physics Letters. 500: 196-201. DOI: 10.1016/J.Cplett.2010.10.007  0.864
2010 Ong SV, Robles R, Khanna SN. Evolution of graphene mediated magnetic coupling between Fe-chains Chemical Physics Letters. 492: 127-130. DOI: 10.1016/J.Cplett.2010.04.041  0.778
2010 Reber AC, Khanna SN, Castleman AW. Superatoms: From motifs to materials Science and Technology of Atomic, Molecular, Condensed Matter and Biological Systems. 1: 365-381. DOI: 10.1016/B978-0-444-53440-8.00009-4  0.508
2009 Reveles JU, Clayborne PA, Reber AC, Khanna SN, Pradhan K, Sen P, Pederson MR. Designer magnetic superatoms. Nature Chemistry. 1: 310-5. PMID 21378872 DOI: 10.1038/Nchem.249  0.836
2009 Claridge SA, Castleman AW, Khanna SN, Murray CB, Sen A, Weiss PS. Cluster-assembled materials. Acs Nano. 3: 244-55. PMID 19236057 DOI: 10.1021/Nn800820E  0.475
2009 Sobhy MA, Reveles JU, Gupta U, Khanna SN, Castleman AW. Photoelectron imaging and theoretical investigation of bimetallic Bi(1-2)Ga(0-2)(-) and Pb(1-4)(-) cluster anions. The Journal of Chemical Physics. 130: 054304. PMID 19206970 DOI: 10.1063/1.3069295  0.54
2009 Roach PJ, Woodward WH, Castleman AW, Reber AC, Khanna SN. Complementary active sites cause size-selective reactivity of aluminum cluster anions with water. Science (New York, N.Y.). 323: 492-5. PMID 19164745 DOI: 10.1126/Science.1165884  0.717
2009 Robles R, Khanna SN. Magnetism in assembled and supported silicon endohedral cages: First-principles electronic structure calculations Physical Review B - Condensed Matter and Materials Physics. 80. DOI: 10.1103/Physrevb.80.115414  0.511
2009 Robles R, Khanna SN. Stable T2Sin (T=Fe,Co,Ni,1 ≤ n ≤ 8) cluster motifs Journal of Chemical Physics. 130. DOI: 10.1063/1.3123808  0.578
2009 Reveles JU, Johnson GE, Khanna SN, Castleman AW. Reactivity Trends in the Oxidation of CO by Anionic Transition Metal Oxide Clusters The Journal of Physical Chemistry C. 114: 5438-5446. DOI: 10.1021/Jp905895W  0.512
2009 Castleman AW, Khanna SN. Clusters, superatoms, and building blocks of new materials Journal of Physical Chemistry C. 113: 2664-2675. DOI: 10.1021/Jp806850H  0.491
2009 Peineke C, Attoui M, Robles R, Reber A, Khanna S, Schmidt-Ott A. Production of equal sized atomic clusters by a hot wire Journal of Aerosol Science. 40: 423-430. DOI: 10.1016/J.Jaerosci.2008.12.008  0.759
2009 Gupta U, Reveles JU, Melko JJ, Khanna SN, Jr. AC. Electron delocalization in a non-cyclic all-metal III–V cluster Chemical Physics Letters. 480: 189-192. DOI: 10.1016/J.Cplett.2009.09.046  0.542
2009 Reber AC, Ugrinov A, Sen A, Qian M, Khanna SN. Helical and linear [K(As11)]2- chains: Role of solvent on the conformation of chains formed by Zintl anions Chemical Physics Letters. 473: 305-311. DOI: 10.1016/J.Cplett.2009.03.082  0.668
2009 Gupta U, Ulises Reveles J, Melko JJ, Khanna SN, Castleman A. Electronic structure of Bi3Gay(-) semiconductor clusters and the special stability of Bi3Ga2- – A gas phase Zintl analogue Chemical Physics Letters. 467: 223-229. DOI: 10.1016/J.Cplett.2008.11.036  0.441
2008 Reber AC, Paranthaman S, Clayborne PA, Khanna SN, Castleman AW. From SiO molecules to silicates in circumstellar space: atomic structures, growth patterns, and optical signatures of SinOm clusters. Acs Nano. 2: 1729-37. PMID 19206378 DOI: 10.1021/Nn7003958  0.813
2008 Jones CE, Clayborne PA, Reveles JU, Melko JJ, Gupta U, Khanna SN, Castleman AW. Al(n)Bi clusters: transitions between aromatic and jellium stability. The Journal of Physical Chemistry. A. 112: 13316-25. PMID 19053539 DOI: 10.1021/Jp804667D  0.857
2008 Gupta U, Reber AC, Clayborne PA, Melko JJ, Khanna SN, Castleman AW. Effect of charge and composition on the structural fluxionality and stability of nine atom tin-bismuth Zintl analogues. Inorganic Chemistry. 47: 10953-8. PMID 18950151 DOI: 10.1021/Ic8011712  0.859
2008 Johnson GE, Reveles JU, Reilly NM, Tyo EC, Khanna SN, Castleman AW. Influence of stoichiometry and charge state on the structure and reactivity of cobalt oxide clusters with CO. The Journal of Physical Chemistry. A. 112: 11330-40. PMID 18855367 DOI: 10.1021/Jp805186R  0.537
2008 Ugrinov A, Sen A, Reber AC, Qian M, Khanna SN. [Te2As2]2-: a planar motif with "conflicting" aromaticity. Journal of the American Chemical Society. 130: 782-3. PMID 18161969 DOI: 10.1021/Ja075513L  0.583
2008 Clayborne P, Jones N, Reber A, Reveles J, Qian M, Khanna S. Superatoms and their assemblies based on alkali and super-alkali motifs Journal of Computational Methods in Sciences and Engineering. 7: 417-430. DOI: 10.3233/Jcm-2007-75-608  0.804
2008 Robles R, Khanna SN, Castleman AW. Stability and magnetic properties of T2 Sin (T=Cr,Mn,1≤n≤8) clusters Physical Review B - Condensed Matter and Materials Physics. 77. DOI: 10.1103/Physrevb.77.235441  0.528
2008 Pradhan K, Sen P, Reveles JU, Khanna SN. First principles study of Sc, Ti, and V dopedNan(n=4,5,6)clusters: Enhanced magnetic moments Physical Review B. 77. DOI: 10.1103/Physrevb.77.045408  0.472
2008 Pradhan K, Sen P, Ulises Reveles J, Khanna SN. First-principles study of TMNan(TM = Cr, Mn, Fe, Co, Ni;n= 4–7) clusters Journal of Physics: Condensed Matter. 20: 255243. DOI: 10.1088/0953-8984/20/25/255243  0.588
2008 Caballero R, Quintanar C, Köster AM, Khanna SN, Reveles JU. Structural and electronic properties of Au and Au2 on an MgO(100) surface: A DFT cluster embedding approach Journal of Physical Chemistry C. 112: 14919-14928. DOI: 10.1021/Jp804355Z  0.386
2007 Knappenberger KL, Clayborne PA, Reveles JU, Sobhy MA, Jones CE, Gupta UU, Khanna SN, Iordanov I, Sofo J, Castleman AW. Anion photoelectron spectroscopy and density functional investigation of diniobium-carbon clusters. Acs Nano. 1: 319-26. PMID 19206683 DOI: 10.1021/Nn700167C  0.831
2007 Reber AC, Khanna SN, Roach PJ, Woodward WH, Castleman AW. Spin accommodation and reactivity of aluminum based clusters with O2. Journal of the American Chemical Society. 129: 16098-101. PMID 18052171 DOI: 10.1021/Ja075998D  0.707
2007 Reveles JU, Calaminici P, Beltrán MR, Köster AM, Khanna SN. H2O nucleation around Au+. Journal of the American Chemical Society. 129: 15565-71. PMID 18034477 DOI: 10.1021/Ja074336L  0.431
2007 Roach PJ, Reber AC, Woodward WH, Khanna SN, Castleman AW. Al4H7(-) is a resilient building block for aluminum hydrogen cluster materials. Proceedings of the National Academy of Sciences of the United States of America. 104: 14565-9. PMID 17823245 DOI: 10.1073/Pnas.0706613104  0.683
2007 Castleman AW, Khanna SN, Sen A, Reber AC, Qian M, Davis KM, Peppernick SJ, Ugrinov A, Merritt MD. From designer clusters to synthetic crystalline nanoassemblies. Nano Letters. 7: 2734-41. PMID 17691749 DOI: 10.1021/Nl071224J  0.741
2007 Reber AC, Khanna SN, Castleman AW. Superatom compounds, clusters, and assemblies: ultra alkali motifs and architectures. Journal of the American Chemical Society. 129: 10189-94. PMID 17655299 DOI: 10.1021/Ja071647N  0.675
2007 Reilly NM, Reveles JU, Johnson GE, Khanna SN, Castleman AW. Experimental and theoretical study of the structure and reactivity of Fe1-2O< or =6- clusters with CO. The Journal of Physical Chemistry. A. 111: 4158-66. PMID 17444620 DOI: 10.1021/Jp070182K  0.456
2007 Douglas Edmonds B, Kandalam AK, Khanna SN, Li X, Grubisic A, Khanna I, Bowen KH. Structure and stability of Co(n)(pyridine)(m)- clusters: absence of metal inserted structures. The Journal of Chemical Physics. 124: 74316. PMID 16497045 DOI: 10.1063/1.2164455  0.497
2007 Cerowski V, Rao BK, Khanna SN, Jena P, Ishii S, Ohno K, Kawazoe Y. Evolution of the electronic structure of Be clusters. The Journal of Chemical Physics. 123: 074329. PMID 16229592 DOI: 10.1063/1.2001655  0.545
2007 Reber AC, Khanna SN, Hunjan JS, Beltran MR. Rings, towers, cages of ZnO European Physical Journal D. 43: 221-224. DOI: 10.1140/Epjd/E2007-00087-7  0.727
2007 Qian M, Ong SV, Khanna SN, Knickelbein MB. Magnetic endohedral metallofullerenes with floppy interiors Physical Review B - Condensed Matter and Materials Physics. 75. DOI: 10.1103/Physrevb.75.104424  0.796
2007 Qian MC, Khanna SN. An ab initio investigation on the endohedral metallofullerene Gd3 N- C80 Journal of Applied Physics. 101. DOI: 10.1063/1.2711420  0.303
2007 Reilly NM, Reveles JU, Johnson GE, Del Campo JM, Khanna SN, Köster AM, Castleman AW. Experimental and theoretical study of the structure and reactivity of FemOn + (m = 1, 2; n = 1-5) with CO Journal of Physical Chemistry C. 111: 19086-19097. DOI: 10.1021/Jp0736239  0.49
2007 Reilly NM, Reveles JU, Johnson GE, Khanna SN, Castleman AW. Influence of charge state on the reaction of FeO3 + / - with carbon monoxide Chemical Physics Letters. 435: 295-300. DOI: 10.1016/J.Cplett.2006.12.054  0.457
2007 Reber AC, Khanna SN, Ottenbrite R. Thermodynamic stability of polyacrylamide and poly(N,N-dimethyl acrylamide) Polymers For Advanced Technologies. 18: 978-985. DOI: 10.1002/Pat.949  0.607
2006 Reveles JU, Khanna SN, Roach PJ, Castleman AW. Multiple valence superatoms. Proceedings of the National Academy of Sciences of the United States of America. 103: 18405-10. PMID 17121987 DOI: 10.1073/Pnas.0608781103  0.534
2006 Reber AC, Clayborne PA, Reveles JU, Khanna SN, Castleman AW, Ali A. Silicon oxide nanoparticles reveal the origin of silicate grains in circumstellar environments. Nano Letters. 6: 1190-5. PMID 16771578 DOI: 10.1021/Nl0605521  0.763
2006 Jones NO, Ulises Reveles J, Khanna SN, Bergeron DE, Roach PJ, Castleman AW. Structural, electronic, and chemical properties of multiply iodized aluminum clusters. The Journal of Chemical Physics. 124: 154311. PMID 16674230 DOI: 10.1063/1.2189218  0.794
2006 Ulises Reveles J, Khanna SN. Electronic counting rules for the stability of metal-silicon clusters Physical Review B - Condensed Matter and Materials Physics. 74. DOI: 10.1103/Physrevb.74.035435  0.472
2006 Jones NO, Reddy BV, Rasouli F, Khanna SN. Erratum: Structural growth in iron oxide clusters: Rings, towers, and hollow drums [Phys. Rev. B72, 165411 (2005)] Physical Review B. 73. DOI: 10.1103/Physrevb.73.119901  0.767
2006 Reber AC, Khanna SN, Hunjan JS, Beltrán MR. Cobalt doped rings and cages of ZnO clusters: Motifs for magnetic cluster-assembled materials Chemical Physics Letters. 428: 376-380. DOI: 10.1016/J.Cplett.2006.07.045  0.74
2006 Morisato T, Jones NO, Khanna SN, Kawazoe Y. Stable aluminum and chromium oxide clusters as precursors to nanoscale materials Computational Materials Science. 35: 366-370. DOI: 10.1016/J.Commatsci.2004.09.061  0.839
2005 Bergeron DE, Roach PJ, Castleman AW, Jones NO, Reveles JU, Khanna SN. Reactions of Al(n)I(x)- with methyl iodide: the enhanced stability of Al7I and the chemical significance of active centers. Journal of the American Chemical Society. 127: 16048-53. PMID 16287291 DOI: 10.1021/Ja050338Z  0.781
2005 Bergeron DE, Roach PJ, Castleman AW, Jones NO, Khanna SN. Al cluster superatoms as halogens in polyhalides and as alkaline earths in iodide salts. Science (New York, N.Y.). 307: 231-5. PMID 15653497 DOI: 10.1126/Science.1105820  0.793
2005 Kandalam AK, Jones NO, Khanna SN, Jena P. Metal-benzene complexes with inserted metal atoms and the possibility of generating magnetic ni-benzene clusters Clusters and Nano-Assemblies: Physical and Biological Systems: Richmond, Virginia, U.S.a., 10-13 November, 2003. 341-348. DOI: 10.1142/9789812701879_0039  0.785
2005 Ulises Reveles J, Khanna SN. Nearly-free-electron gas in a silicon cage Physical Review B - Condensed Matter and Materials Physics. 72. DOI: 10.1103/Physrevb.72.165413  0.49
2005 Jones NO, Reddy BV, Rasouli F, Khanna SN. Structural growth in iron oxide clusters: Rings, towers, and hollow drums Physical Review B - Condensed Matter and Materials Physics. 72. DOI: 10.1103/Physrevb.72.165411  0.797
2005 Morisato T, Khanna SN, Kawazoe Y. First-principles study of the onset of noncollinearity in Mnn clusters: Magnetic arrangements in Mn5 and Mn6 Physical Review B - Condensed Matter and Materials Physics. 72. DOI: 10.1103/Physrevb.72.014435  0.517
2005 Bergeron DE, Castleman AW, Jones NO, Khanna SN. Association of C3H6 to aluminum cluster anions Chemical Physics Letters. 415: 230-233. DOI: 10.1016/J.Cplett.2005.08.144  0.8
2005 Khanna SN. Stable cluster motifs for nanoscale materials Acs National Meeting Book of Abstracts. 230.  0.455
2004 Bergeron DE, Castleman AW, Morisato T, Khanna SN. Formation and properties of halogenated aluminum clusters. The Journal of Chemical Physics. 121: 10456-66. PMID 15549926 DOI: 10.1063/1.1806416  0.49
2004 Reddy BV, Khanna SN. Self-stimulated NO reduction and CO oxidation by iron oxide clusters Physical Review Letters. 93. PMID 15323667 DOI: 10.1103/Physrevlett.93.068301  0.39
2004 Bergeron DE, Castleman AW, Morisato T, Khanna SN. Formation of Al13I-: evidence for the superhalogen character of Al13. Science (New York, N.Y.). 304: 84-7. PMID 15066775 DOI: 10.1126/Science.1093902  0.559
2004 Jones NO, Beltran MR, Khanna SN, Baruah T, Pederson MR. Hydrogen adsorption and magnetic behavior of Fen and Co n clusters: Controlling the magnetic moment and anisotropy one atom at a time [79] Physical Review B - Condensed Matter and Materials Physics. 70: 1-7. DOI: 10.1103/Physrevb.70.165406  0.804
2004 Jones NO, Khanna SN, Baruah T, Pederson MR, Zheng WJ, Nilles JM, Bowen KH. Magnetic isomers and local moment distribution in Mn5O and Mn6O clusters Physical Review B - Condensed Matter and Materials Physics. 70. DOI: 10.1103/Physrevb.70.134422  0.802
2004 Jones NO, Khanna SN, Baruah T, Pederson MR. Classical Stern-Gerlach profiles of Mn5 and Mn6 clusters Physical Review B - Condensed Matter and Materials Physics. 70. DOI: 10.1103/Physrevb.70.045416  0.801
2004 Khanna SN, Jena P, Zheng W, Nilles JM, Bowen KH. Spectroscopic signature of magnetic bistability inMn2O−anions and its implications for piezomagnetism at the nanoscale Physical Review B. 69. DOI: 10.1103/Physrevb.69.144418  0.362
2004 Bergeron DE, Castleman AW, Jones NO, Khanna SN. Stable Cluster Motifs for Nanoscale Chromium Oxide Materials Nano Letters. 4: 261-265. DOI: 10.1021/Nl034997Q  0.755
2004 Reddy B, Rasouli F, Hajaligol M, Khanna S. Novel mechanism for oxidation of CO by Fe2O3 clusters Fuel. 83: 1537-1541. DOI: 10.1016/J.Fuel.2003.12.015  0.448
2004 Reddy B, Rasouli F, Hajaligol M, Khanna S. Novel pathway for CO oxidation on a Fe2O3 cluster Chemical Physics Letters. 384: 242-245. DOI: 10.1016/J.Cplett.2003.12.023  0.453
2003 Rusyniak MJ, Ibrahim YM, Wright DL, Khanna SN, El-Shall MS. Gas-phase ion mobilities and structures of benzene cluster cations (C6H6)n+, n = 2-6. Journal of the American Chemical Society. 125: 12001-13. PMID 14505422 DOI: 10.1021/Ja035504M  0.546
2003 Reddy BV, Deevi SC, Khanna SN. Magnetic properties of Al, V, Mn, and Ru impurities in Fe-Co alloys Journal of Applied Physics. 93: 2823-2827. DOI: 10.1063/1.1541109  0.391
2003 Khanna S, Rao B, Jena P, Knickelbein M. Ferrimagnetism in Mn7 cluster Chemical Physics Letters. 378: 374-379. DOI: 10.1016/S0009-2614(03)01235-1  0.482
2003 Khanna S, Rao B, Jena P, Nayak S. Stability and magnetic properties of iron atoms encapsulated in Si clusters Chemical Physics Letters. 373: 433-438. DOI: 10.1016/S0009-2614(03)00511-6  0.484
2003 Ashman C, Khanna SN, Pederson MR. Hydrogen absorption and magnetic moment of Nin clusters Chemical Physics Letters. 368: 257-261. DOI: 10.1016/S0009-2614(02)01807-9  0.546
2002 Ashman C, Khanna SN, Pederson MR. Electron attachment and dynamics of alkali atoms inAl13X(X=Li–Cs)clusters Physical Review B. 66. DOI: 10.1103/Physrevb.66.193408  0.5
2002 Kortus J, Baruah T, Pederson MR, Ashman C, Khanna SN. Magnetic moment and anisotropy in FenCom clusters Applied Physics Letters. 80: 4193-4195. DOI: 10.1063/1.1482793  0.512
2002 Pederson MR, Kortus J, Khanna SN. Electronic-structure-based investigation of magnetism in the Fe 8 molecular magnet Journal of Applied Physics. 91: 7149-7151. DOI: 10.1063/1.1450786  0.352
2002 Chen B, Castleman A, Ashman C, Khanna S. NH3 adsorption around Nin (n ≤ 4) clusters International Journal of Mass Spectrometry. 220: 171-182. DOI: 10.1016/S1387-3806(02)00826-6  0.57
2002 Ashman C, Khanna SN, Pederson MR. Dynamical effects on the photo-detachment spectra of Li-4 Chemical Physics Letters. 351: 289-294. DOI: 10.1016/S0009-2614(01)01383-5  0.36
2002 Ashman C, Khanna SN, Pederson MR. Electron attachment and dynamics of alkali atoms in Al13X (X=Li-Cs) clusters Physical Review B - Condensed Matter and Materials Physics. 66: 1934081-1934084.  0.424
2002 Khanna SN, Rao BK, Jena P. Electronic signature of the magicity and ionic bonding in Al13X (X = Li-K) clusters Physical Review B - Condensed Matter and Materials Physics. 65: 1251051-1251055.  0.435
2002 Khanna SN, Rao BK, Jena P. Magic numbers in metallo-inorganic clusters: Chromium encapsulated in silicon cages Physical Review Letters. 89: 168031-168034.  0.496
2001 Khanna SN, Beltran M, Jena P. Relationship between photoelectron spectroscopy and the magnetic moment of Ni7 clusters Physical Review B - Condensed Matter and Materials Physics. 64: 2354191-2354194. DOI: 10.1103/Physrevb.64.235419  0.514
2001 Reddy BV, Sastry DH, Deevi SC, Khanna SN. Magnetic coupling and site occupancy of impurities in Fe3Al Physical Review B - Condensed Matter and Materials Physics. 64: 2244191-2244194. DOI: 10.1103/Physrevb.64.224419  0.37
2001 Reddy BV, Deevi SC, Reuse FA, Khanna SN. Effect of size, disorder, and impurities on magnetism in FeAl Physical Review B - Condensed Matter and Materials Physics. 64: 1324081-1324084. DOI: 10.1103/Physrevb.64.132408  0.412
2001 Gutsev GL, Jena P, Rao BK, Khanna SN. Electronic structure and chemical bonding of 3d-metal dimers ScX, X = Sc-Zn Journal of Chemical Physics. 114: 10738-10748. DOI: 10.1063/1.1373693  0.4
2001 Khanna SN, Ashman C, Rao BK, Jena P. Geometry, electronic structure, and energetics of copper-doped aluminum clusters Journal of Chemical Physics. 114: 9792-9796. DOI: 10.1063/1.1367381  0.547
2001 Leskiw BD, Castleman AW, Ashman C, Khanna SN. Reactivity and electronic structure of aluminum clusters: The aluminum-nitrogen system Journal of Chemical Physics. 114: 1165-1169. DOI: 10.1063/1.1333017  0.577
2001 Martins JL, Reuse FA, Khanna SN. Growth and Formation of Fullerene Clusters Journal of Cluster Science. 12: 513-525. DOI: 10.1023/A:1012883531265  0.587
2001 Jena P, Khanna SN, Rao BK. The Role of Interface on the Properties of Cluster Assemblies Journal of Cluster Science. 12: 443-456. DOI: 10.1023/A:1012875329448  0.555
2001 Gutsev GL, Khanna SN, Jena P. Magnetic excitations of Co2 dimer Chemical Physics Letters. 345: 481-489. DOI: 10.1016/S0009-2614(01)00880-6  0.31
2001 Khanna SN, Jena P. Magnetic moment and photo-detachment spectroscopy of Ni5 clusters Chemical Physics Letters. 336: 467-472. DOI: 10.1016/S0009-2614(01)00152-X  0.479
2001 Reddy BV, Khanna SN, Deevi SC. Electronic structure and magnetism in (FeAl)n(n≤6) clusters Chemical Physics Letters. 333: 465-470. DOI: 10.1016/S0009-2614(00)01393-2  0.553
2001 Kortus J, Pederson M, Hellberg C, Khanna S. DFT studies of the molecular nanomagnet Fe 8 and the V 15 spin system The European Physical Journal D. 16: 177-180. DOI: 10.1007/S100530170086  0.365
2000 Ashman C, Khanna SN, Pederson MR, Kortus J. Al7CX (X = Li-Cs) clusters: Stability and the prospect for cluster materials Physical Review B - Condensed Matter and Materials Physics. 62: 16956-16961. DOI: 10.1103/Physrevb.62.16956  0.589
2000 Gutsev GL, Khanna SN, Jena P. Unambiguous assignment of the ground state of a nearly degenerate cluster Physical Review B - Condensed Matter and Materials Physics. 62: 1604-1606. DOI: 10.1103/Physrevb.62.1604  0.525
2000 Reddy BV, Khanna SN, Ashman C. Oscillatory magnetic coupling inCr2On (n=1–6)clusters Physical Review B. 61: 5797-5801. DOI: 10.1103/Physrevb.61.5797  0.468
2000 Desmarais N, Reuse FA, Khanna SN. Magnetic coupling in neutral and charged Cr2, Mn2, and CrMn dimers The Journal of Chemical Physics. 112: 5576-5584. DOI: 10.1063/1.481183  0.339
2000 Pederson MR, Porezag DV, Kortus J, Khanna SN. Theoretical calculations of magnetic order and anisotropy energies in molecular magnets Journal of Applied Physics. 87: 5487-5489. DOI: 10.1063/1.373380  0.471
2000 Ashman C, Khanna SN, Pederson MR. Reactivity of Al n C clusters with oxygen: Search for new magic clusters Chemical Physics Letters. 324: 137-142. DOI: 10.1016/S0009-2614(00)00569-8  0.599
2000 Cerovski VZ, Mahanti SD, Khanna SN. Magnetization of Gd \(\) cluster: Anomalous thermal behavior European Physical Journal D. 10: 119-122. DOI: 10.1007/S100530050532  0.444
2000 Ashman C, Khanna SN, Pederson MR. Structure and isomerization in alkali halide clusters Physica Status Solidi (B) Basic Research. 217: 323-334. DOI: 10.1002/(Sici)1521-3951(200001)217:1<323::Aid-Pssb323>3.0.Co;2-A  0.513
2000 Reddy BV, Khanna SN, Ashman C. Oscillatory magnetic coupling in Cr2On (n=1-6) clusters Physical Review B - Condensed Matter and Materials Physics. 61: 5797-5801.  0.35
2000 Rao BK, Khanna SN, Jena P. Isomers of Al13 clusters and their interaction with alkali atoms Physical Review B - Condensed Matter and Materials Physics. 62: 4666-4671.  0.361
2000 Cerovski VZ, Mahanti SD, Khanna SN. Magnetization of Gd13 cluster: Anomalous thermal behavior European Physical Journal D. 10: 119-122.  0.334
1999 Reddy BV, Khanna SN. Chemically Induced Oscillatory Exchange Coupling in Chromium Oxide Clusters Physical Review Letters. 83: 3170-3173. DOI: 10.1103/Physrevlett.83.3170  0.508
1999 Pederson MR, Khanna SN. Magnetic anisotropy barrier for spin tunneling in Mn12O12 molecules Physical Review B - Condensed Matter and Materials Physics. 60: 9566-9572. DOI: 10.1103/Physrevb.60.9566  0.365
1999 Reddy BV, Khanna SN, Jena P. Structure and magnetic ordering inCr8andCr13clusters Physical Review B. 60: 15597-15600. DOI: 10.1103/Physrevb.60.15597  0.419
1999 Pederson MR, Khanna SN. Electronic structure and magnetism of Mn12O12 clusters Physical Review B - Condensed Matter and Materials Physics. 59. DOI: 10.1103/PhysRevB.59.R693  0.413
1999 Reddy BV, Nayak SK, Khanna SN, Rao BK, Jena P. Electronic structure and magnetism ofRhn(n=2–13)clusters Physical Review B. 59: 5214-5222. DOI: 10.1103/Physrevb.59.5214  0.522
1999 Gutsev GL, Khanna SN, Rao BK, Jena P. FeO4:A unique example of a closed-shell cluster mimicking a superhalogen Physical Review A. 59: 3681-3684. DOI: 10.1103/Physreva.59.3681  0.439
1999 Rao BK, Khanna SN, Jena P. Designing New Materials Using Atomic Clusters Journal of Cluster Science. 10: 477-491. DOI: 10.1023/A:1021948806958  0.472
1999 Gutsev GL, Khanna SN, Rao BK, Jena P. Electronic Structure and Properties of FeOnand FeOn-Clusters The Journal of Physical Chemistry A. 103: 5812-5822. DOI: 10.1021/Jp9909006  0.515
1999 Pederson MR, Khanna SN. Electronic and geometrical structure and magnetic ordering in passivated Mn 12 O 12 -acetate nanomagnets Chemical Physics Letters. 307: 253-258. DOI: 10.1016/S0009-2614(99)00525-4  0.447
1999 Chen B, Castleman AW, Khanna SN. Structure, reactivity, and magnetism: Adsorption of NH3 around Nin Chemical Physics Letters. 304: 423-428. DOI: 10.1016/S0009-2614(99)00328-0  0.389
1999 Reuse FA, Khanna SN. Photoabsorption spectrum of small \(\) (n=2-6, 13) clusters European Physical Journal D. 6: 77-81. DOI: 10.1007/S100530050286  0.541
1999 Reuse FA, Khanna SN. Photoabsorption spectrum of small Nin (n=2-6, 13) clusters European Physical Journal D. 6: 77-81.  0.447
1999 Reddy BV, Khanna SN, Jena P. Structure and magnetic ordering in Cr8 and Cr13 clusters Physical Review B - Condensed Matter and Materials Physics. 60: 15597-15600.  0.334
1999 Gutsev GL, Khanna SN, Rao BK, Jena P. FeO4: A unique example of a closed-shell cluster mimicking a superhalogen Physical Review a - Atomic, Molecular, and Optical Physics. 59: 3681-3684.  0.352
1999 Gutsev GL, Khanna SN, Rao BK, Jena P. Electronic Structure and Properties of FeOn and FeOn- Clusters Journal of Physical Chemistry A. 103: 5812-5822.  0.461
1998 Pederson MR, Reuse F, Khanna SN. Magnetic transition in Mnn (n=2-8) clusters Physical Review B - Condensed Matter and Materials Physics. 58: 5632-5636. DOI: 10.1103/Physrevb.58.5632  0.496
1998 Gutsev GL, Reddy BV, Khanna SN, Rao BK, Jena P. Optically induced magnetism in cobalt iron cyanide Physical Review B. 58: 14131-14134. DOI: 10.1103/Physrevb.58.14131  0.348
1998 Nayak SK, Khanna SN, Jena P. Evolution of bonding in AlnN clusters: A transition from nonmetallic to metallic character Physical Review B - Condensed Matter and Materials Physics. 57: 3787-3790. DOI: 10.1103/Physrevb.57.3787  0.598
1998 Ashman C, Khanna SN, Pederson MR, Porezag DV. Thermal isomerization in Cs4Cl3- Physical Review a - Atomic, Molecular, and Optical Physics. 58: 744-747. DOI: 10.1103/Physreva.58.744  0.423
1998 Nayak SK, Khanna SN, Rao BK, Jena P. Thermodynamics of small nickel clusters Journal of Physics Condensed Matter. 10: 10853-10862. DOI: 10.1088/0953-8984/10/48/008  0.528
1998 Nayak SK, Rao BK, Khanna SN, Jena P. Atomic and electronic structure of neutral and charged SinOm clusters Journal of Chemical Physics. 109: 1245-1250. DOI: 10.1063/1.476675  0.605
1998 Reddy BV, Nayak SK, Khanna SN, Rao BK, Jena P. Physics of Nickel Clusters. 2. Electronic Structure and Magnetic Properties The Journal of Physical Chemistry A. 102: 1748-1759. DOI: 10.1021/Jp980262B  0.478
1998 Desmarais N, Jamorski C, Reuse F, Khanna S. Atomic arrangements in Ni7 and Ni8 clusters Chemical Physics Letters. 294: 480-486. DOI: 10.1016/S0009-2614(98)00906-3  0.505
1998 Desmarais N, Jamorski C, Reuse FA, Khanna SN. Atomic arrangements in Ni7 and Ni8 clusters Chemical Physics Letters. 294: 480-486.  0.407
1997 Zheng H, Rao BK, Khanna SN, Jena P. Electronic structure and binding energies of hydrogen-decorated vacancies in Ni Physical Review B - Condensed Matter and Materials Physics. 55: 4174-4181. DOI: 10.1103/Physrevb.55.4174  0.429
1997 Ashman C, Khanna SN, Liu F, Jena P, Kaplan T, Mostoller M. (BAl12)Cs:mA cluster-assembled solid Physical Review B. 55: 15868-15873. DOI: 10.1103/Physrevb.55.15868  0.427
1997 Pappas DP, Sherwood TS, Reddy BV, Khanna SN, Popov AP, Anisimov AN. Spin configuration of Gd clusters and thin films (abstract) Journal of Applied Physics. 81: 5542-5542. DOI: 10.1063/1.364654  0.553
1997 Nayak SK, Khanna SN, Rao BK, Jena P. Physics of nickel clusters: Energetics and equilibrium geometries Journal of Physical Chemistry A. 101: 1072-1080. DOI: 10.1021/Jp962720R  0.535
1997 Reuse FA, Khanna SN, Reddy BV, Buttet J. N2 adsorption around small Nin (n=2−4) clusters Chemical Physics Letters. 267: 258-262. DOI: 10.1016/S0009-2614(97)00104-8  0.517
1997 Reuse FA, Khanna SN, Reddy BV, Buttet J. N2 adsorption around small Nin (n = 2-4) clusters Chemical Physics Letters. 267: 258-262.  0.436
1996 Pappas DP, Popov AP, Anisimov AN, Reddy BV, Khanna SN. Spin configuration of Gd13 clusters. Physical Review Letters. 76: 4332-4335. PMID 10061263 DOI: 10.1103/Physrevlett.76.4332  0.527
1996 Jena P, Khanna SN, Rao BK. Stability and electronic structure of cluster assembled materials Materials Science Forum. 232: 1-26. DOI: 10.4028/Www.Scientific.Net/Msf.232.1  0.588
1996 Jena P, Khanna SN, Rao BK. Designing clusters as superelements Surface Review and Letters. 3: 993-999. DOI: 10.1142/S0218625X96001789  0.565
1996 Jena P, Khanna SN. Physics of cluster assembled materials Materials Science and Engineering A. 217: 218-222. DOI: 10.1016/S0921-5093(96)10361-0  0.575
1996 Nayak SK, Rao BK, Khanna SN, Jena P. Structural isomerism of niobium clusters and its role on reactivity Chemical Physics Letters. 259: 588-592. DOI: 10.1016/0009-2614(96)00830-5  0.539
1996 Nayak SK, Reddy B, Rao B, Khanna S, Jena P. Structure and properties of Ni7 cluster isomers Chemical Physics Letters. 253: 390-396. DOI: 10.1016/0009-2614(96)00299-0  0.434
1996 Liu F, Mostoller M, Kaplan T, Khanna S, Jena P. Evidence for a new class of solids. First-principles study of K(Al13) Chemical Physics Letters. 248: 213-217. DOI: 10.1016/0009-2614(95)01339-3  0.389
1996 Reddy BV, Khanna SN. Structure and stability of TinNm clusters Physical Review B - Condensed Matter and Materials Physics. 54: 2240-2243.  0.518
1995 Reuse FA, Khanna SN, Bernel S. Electronic structure and magnetic behavior of Ni13 clusters Physical Review B. 52. DOI: 10.1103/PhysRevB.52.R11650  0.443
1995 Khanna SN, Jena P. Atomic clusters: Building blocks for a class of solids Physical Review B. 51: 13705-13716. DOI: 10.1103/Physrevb.51.13705  0.579
1995 Reuse FA, Khanna SN. Geometry, electronic structure, and magnetism of small Nin (n = 2-6, 8, 13) clusters Chemical Physics Letters. 234: 77-81. DOI: 10.1016/0009-2614(95)00012-S  0.55
1994 Harms AC, Khanna SN, Chen B, Castleman AW. Dehydrogenation reactions in Mg+(H2O)n clusters The Journal of Chemical Physics. 100: 3540-3544. DOI: 10.1063/1.466396  0.363
1994 Reddy BV, Khanna SN. Metallocarbohedrenes: A new class of metal-carbon assemblies Journal of Physical Chemistry. 98: 9446-9449. DOI: 10.1021/J100089A015  0.463
1994 Khanna SN, Reddy BV. Geometry, stability and properties of metallo-carbohederenes Computational Materials Science. 2: 638-642. DOI: 10.1016/0927-0256(94)90100-7  0.382
1994 Reddy B, Khanna S, Jena P, Press M, Jaswal S. Magnetic properties of transition metal superlattices Journal of Magnetism and Magnetic Materials. 130: 255-260. DOI: 10.1016/0304-8853(94)90681-5  0.325
1994 Khanna SN, Jena P. Designing ionic solids from metallic clusters Chemical Physics Letters. 219: 479-483. DOI: 10.1016/0009-2614(94)00097-2  0.539
1994 Khanna SN, Jena P. Reactivity of hydrogen with open and closed shell clusters Chemical Physics Letters. 218: 383-386. DOI: 10.1016/0009-2614(93)E1490-8  0.548
1993 Liu F, Khanna SN, Magaud L, Jena P, de Coulon V, Reuse F, Jaswal SS, He X, Cyrot-Lackman F. Magnetism of Al-Mn quasicrystals. Physical Review. B, Condensed Matter. 48: 1295-1298. PMID 10007997 DOI: 10.1103/Physrevb.48.1295  0.404
1993 Reddy BV, Khanna SN, Dunlap BI. Giant magnetic moments in 4d clusters Physical Review Letters. 70: 3323-3326. DOI: 10.1103/Physrevlett.70.3323  0.534
1993 Antonelli A, Khanna SN, Jena P. Thermal stability of supported metal clusters Physical Review B. 48: 8263-8266. DOI: 10.1103/Physrevb.48.8263  0.553
1993 De Coulon V, Reuse FA, Khanna SN. Effect of icosahedral and cuboctahedral symmetries on the electronic and magnetic structure of MnAln Physical Review B. 48: 814-828. DOI: 10.1103/Physrevb.48.814  0.562
1993 Manninen M, Mansikka-aho J, Khanna SN, Jena P. Band structures of solids composed of metal clusters Solid State Communications. 85: 11-14. DOI: 10.1016/0038-1098(93)90908-6  0.54
1993 Khanna SN, Reuse F. Hydrogen absorption around neutral and charged Ni atoms Chemical Physics Letters. 205: 248-252. DOI: 10.1016/0009-2614(93)89238-D  0.491
1993 Reddy BV, Khanna SN. Formation and stability of dodecahedral and fcc structures in metal-carbon clusters Chemical Physics Letters. 209: 104-108. DOI: 10.1016/0009-2614(93)87209-L  0.491
1992 Jena P, Khanna S, Rao B. CLUSTERS WITH NOVEL PROPERTIES International Journal of Modern Physics B. 6: 3657-3666. DOI: 10.1142/S0217979292001717  0.572
1992 Reddy BV, Khanna SN, Jena P. Electronic, magnetic, and geometric structure of metallo-carbohedrenes Science. 258: 1640-1643. DOI: 10.1126/Science.258.5088.1640  0.447
1992 Khanna SN, Jena P. Assembling crystals from clusters Physical Review Letters. 69: 1664-1667. DOI: 10.1103/Physrevlett.69.1664  0.551
1992 Yannouleas C, Jena P, Khanna SN. Optical resonances in bimetallic clusters and their relation to the electronic structure Physical Review B. 46: 9751-9760. DOI: 10.1103/PhysRevB.46.9751  0.454
1992 Rao BK, Khanna SN, Jena P. Role of excess electrons on the stability of metal-cluster hydrides Physical Review B. 45: 13631-13635. DOI: 10.1103/Physrevb.45.13631  0.568
1992 Reddy BV, Khanna SN. Effect of geometry on magnetism in small antiferromagnetic clusters Physical Review B. 45: 10103-10106. DOI: 10.1103/Physrevb.45.10103  0.553
1992 Khanna SN, Jena P. Novel phenomenon in charged clusters Nanostructured Materials. 1: 137-142. DOI: 10.1016/0965-9773(92)90066-7  0.386
1992 Linderoth S, Khanna SN. Superparamagnetic behaviour of ferromagnetic transition metal clusters Journal of Magnetism and Magnetic Materials. 104: 1574-1576. DOI: 10.1016/0304-8853(92)91460-B  0.545
1991 McMullen T, Jena P, Khanna SN. Screening of a Positive Muon by a Semion Gas International Journal of Modern Physics B. 5: 1579-1588. DOI: 10.1142/S0217979291001486  0.306
1991 Khanna SN, Linderoth S. Magnetic behavior of clusters of ferromagnetic transition metals Physical Review Letters. 67: 742-745. DOI: 10.1103/Physrevlett.67.742  0.525
1991 Liu F, Khanna SN, Jena P. Magnetism in small vanadium clusters Physical Review B. 43: 8179-8182. DOI: 10.1103/Physrevb.43.8179  0.531
1991 Rao BK, Khanna SN, Jena P. Energetics and electronic structures of hydrogenated metal clusters Physical Review B. 43: 1416-1421. DOI: 10.1103/Physrevb.43.1416  0.533
1991 Jena P, Rao BK, Khanna SN. Energetics and electronic structure of hydrogenated clusters Journal of the Less-Common Metals. 172: 387-394. DOI: 10.1016/0022-5088(91)90471-F  0.56
1991 Weber SE, Liu F, Khanna SN, Rao BK, Jena P. Theory of hydrogen pairing in metals Journal of the Less Common Metals. 485-495. DOI: 10.1016/0022-5088(91)90169-5  0.316
1991 Niu J, Rao BK, Khanna SN, Jena P. The origin of anomalous bond dissociation energies of V+ (H2)n clusters Chemical Physics Letters. 230: 299-305. DOI: 10.1016/0009-2614(94)01166-4  0.462
1991 Magaud L, Khanna SN, Jena P. Limitation on the success of the jellium model for metal clusters Chemical Physics Letters. 183: 333-336. DOI: 10.1016/0009-2614(91)90387-O  0.553
1991 Rao BK, Khanna SN, Meng J, Jena P. Geometries and binding energies of small beryllium clusters using various levels of approximations for exchange and correlation: a comparative study Zeitschrift FüR Physik D Atoms, Molecules and Clusters. 18: 171-174. DOI: 10.1007/Bf01437443  0.433
1990 Jena P, Khanna SN, Rao BK, Manninen M. Clusters-a New Source for Atomically Engineered Materials Mrs Proceedings. 206. DOI: 10.1557/Proc-206-3  0.59
1990 Khanna SN, Reuse F, de Coulon V, Buttet J. Physics of Charged Mgn (n≤7) and Mixed MgnKy (x+y≤4) Clusters Mrs Proceedings. 206. DOI: 10.1557/Proc-206-27  0.57
1990 Li Y, Khanna SN, Jena P. Comment on charge exchange and metastability of small multiply charged gold clusters Physical Review Letters. 64: 1188. DOI: 10.1103/Physrevlett.64.1188  0.378
1990 Liu F, Khanna SN, Jena P. Quantum size effect on the magnetism of finite systems Physical Review B. 42: 976-979. DOI: 10.1103/Physrevb.42.976  0.317
1990 Reuse F, Khanna SN, De Coulon V, Buttet J. Pseudopotential local-spin-density studies of neutral and charged Mgn (n7) clusters Physical Review B. 41: 11743-11759. DOI: 10.1103/PhysRevB.41.11743  0.518
1990 Rao BK, Khanna SN, Jena P. Clusters-A New Phase Of Matter Phase Transitions. 24: 35-60. DOI: 10.1080/01411599008210227  0.542
1990 Liu F, Khanna SN, Jena P. Effect of size and dimensionality on the magnetic moment of transition metals Journal of Applied Physics. 67: 4484-4486. DOI: 10.1063/1.344889  0.414
1990 Liu F, Khanna SN, Jena P. ab-initio tight-binding theory for the electronic structure Journal of Non-Crystalline Solids. 117: 297-299. DOI: 10.1016/0022-3093(90)90936-G  0.429
1990 Jena P, Khanna SN, Rao BK. Reaction-induced excitations of clusters Chemical Physics Letters. 171: 439-442. DOI: 10.1016/0009-2614(90)85243-6  0.537
1990 Press MR, Khanna SN, Jena P, Puska MJ. Energetics, electronic structure, and positron annihilation studies of carbon-vacancy complexes in iron Zeitschrift FüR Physik B Condensed Matter. 81: 281-289. DOI: 10.1007/Bf01309360  0.361
1989 Reuse F, Khanna SN, de Coulon V, Buttet J. Behavior of magnesium clusters under electron attachment and detachment. Physical Review. B, Condensed Matter. 39: 12911-12914. PMID 9948169 DOI: 10.1103/Physrevb.39.12911  0.603
1989 Liu F, Challa M, Khanna SN, Jena P. Theory of hydrogen pairing in yttrium Physical Review Letters. 63: 1396-1399. DOI: 10.1103/Physrevlett.63.1396  0.359
1989 Khanna SN, Jena P, Rao BK. Charge-exchange reactions in metal clusters: Role of magic numbers Physical Review B. 40: 966-969. DOI: 10.1103/Physrevb.40.966  0.515
1989 Press MR, Liu F, Khanna SN, Jena P. Magnetism and local order. II. Self-consistent cluster calculations Physical Review B. 40: 399-406. DOI: 10.1103/Physrevb.40.399  0.472
1989 Shimamura S, Khanna SN, Jena P. Self-consistent phonon approach to thermal vibrations in model small clusters Physical Review B. 40: 2459-2463. DOI: 10.1103/PhysRevB.40.2459  0.433
1989 Liu F, Press MR, Khanna SN, Jena P. Magnetism and local order: Ab initio tight-binding theory Physical Review B. 39: 6914-6924. DOI: 10.1103/Physrevb.39.6914  0.449
1989 Reuse F, Khanna SN, De Coulon V, Buttet J. Behavior of magnesium clusters under electron attachment and detachment Physical Review B. 39: 12911-12914. DOI: 10.1103/PhysRevB.39.12911  0.522
1989 Liu F, Rao BK, Khanna SN, Jena P. Nature of short range interaction between deuterium atoms in Pd Solid State Communications. 72: 891-894. DOI: 10.1016/0038-1098(89)90421-3  0.31
1989 Liu F, Press MR, Khanna SN, Jena P. Magnetism and local order Zeitschrift F�R Physik D Atoms, Molecules and Clusters. 12: 361-363. DOI: 10.1007/Bf01426972  0.456
1989 Blaisten-Barojas E, Khanna SN. Model potential for beryllium clusters Zeitschrift FüR Physik D Atoms, Molecules and Clusters. 12: 77-79. DOI: 10.1007/BF01426909  0.433
1989 Khanna SN, Reuse F, Buttet J. Electronic structure and stability of charged beryllium clusters Zeitschrift FüR Physik D Atoms, Molecules and Clusters. 12: 357-359. DOI: 10.1007/978-3-642-74913-1_79  0.581
1989 Blaisten-Barojas E, Khanna SN. Model potential for beryllium clusters European Physical Journal D. 12: 77-79. DOI: 10.1007/978-3-642-74913-1_17  0.533
1988 Khanna SN, Reuse F, Buttet J. Stability and observability of charged beryllium clusters. Physical Review Letters. 61: 535-538. PMID 10039361 DOI: 10.1103/Physrevlett.61.535  0.531
1988 Khanna SN, Rao BK, Jena P, Esterling D, Puska MJ. Atomic relaxations around vacancy clusters in molybdenum and their effects on trapped-positron lifetime. Physical Review B. 37: 6-11. PMID 9943540 DOI: 10.1103/Physrevb.37.6  0.384
1988 Khanna SN, Reuse F, Buttet J. Stability and observability of charged beryllium clusters Physical Review Letters. 61: 535-538. DOI: 10.1103/PhysRevLett.61.535  0.429
1988 Blaisten-Barojas E, Khanna SN. Development of a first-principles many-body potential for beryllium Physical Review Letters. 61: 1477-1480. DOI: 10.1103/Physrevlett.61.1477  0.451
1988 Liu F, Press MR, Khanna SN, Jena P. Simple theory of electronic structure: Clusters to crystals Physical Review B. 38: 5760-5763. DOI: 10.1103/Physrevb.38.5760  0.504
1987 Liu F, Press MR, Khanna SN, Jena P. Stability of doubly charged transition-metal dimers Physical Review Letters. 59: 2562-2565. DOI: 10.1103/Physrevlett.59.2562  0.365
1987 Rao BK, Khanna SN, Jena P. Evolution of the electronic and structural properties of microclusters Physical Review B. 36: 953-960. DOI: 10.1103/PhysRevB.36.953  0.514
1987 Press MR, Khanna SN, Jena P. Electronic structure, magnetic behavior, and stability of Ni-P Physical Review B. 36: 5446-5453. DOI: 10.1103/Physrevb.36.5446  0.383
1986 Rao BK, Khanna SN, Jena P. AB initio studies of the electronic structure of micro-clusters Ultramicroscopy. 20: 51-54. DOI: 10.1016/0304-3991(86)90168-3  0.519
1986 Rao BK, Khanna SN, Jena P. Equilibrium geometries, magic numbers and electronic structure of small carbon clusters Solid State Communications. 58: 53-56. DOI: 10.1016/0038-1098(86)90886-0  0.405
1986 Rao BK, Khanna SN, Jena P. Structural and electronic properties of compound metal clusters Zeitschrift FüR Physik D Atoms, Molecules and Clusters. 3: 219-222. DOI: 10.1007/Bf01384810  0.584
1985 Rao BK, Khanna SN, Jena P. Equilibrium geometries of small metal clusters and their relationship to crystalline structure Solid State Communications. 56: 731-734. DOI: 10.1016/0038-1098(85)90789-6  0.562
1985 Rao BK, Khanna SN, Jena P. Electronically driven magnetic transition and dimensionality crossover in Li4 clusters Chemical Physics Letters. 121: 202-204. DOI: 10.1016/0009-2614(85)85510-X  0.438
1981 Khanna SN, Cyrot-Lackmann F, Boudeville Y, Rousseau-Voilet J. Electronic structure of cubooctahedral clusters of platinum Surface Science. 106: 287-292. DOI: 10.1016/0039-6028(81)90213-2  0.469
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