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176 Miller, Joel Steven; Epstein, Arthur J.Ferromagnetic behavior of decamethylchromocenium tetracyanoethenide, [CrCp*2][TCNE]Studies on the magnetic properties of decamethylchromocenium tetracyanoethanide, [CrCp*2][TCNE] are reported herein. Near-zero field (H= 150 mG) data indicates a ferromagnetic transition with T(c)=3.65 K. The temperature dependence below T(c) can be fit to a mean-field result M=M(o)(1 - T(o))(1/2)...Magnetic; Magnetization; Transition1993
177 Armentrout, Peter B.Energy dependence, kinetic isotope effects, and thermochemistry of the nearly thermoneutral reactions of N+(3P) + H2(HD, D2) → NH+(ND+) + H(D)The reactions of N + (3P) ions with H2 , HD, D2 are examined using guided ion beam tandem mass spectroscopy. Absolute reaction cross sections are measured from near thermal energies to 30 eV relative energy. The low energy cross section behavior is analyzed using empirical threshold models and ph...Thermoneutral reactions; Ion-molecule reactions; Translational energy; Bond energy; Threshold behavior; Phase space theory1987
178 Morse, Michael DavidElectron spin resonance investigation of Sc?+ in neon matrices and assignment of its ground electronic state as X ???. comparison with theoretical calculationsThe discandium radical cation, Sc+2 , has been isolated in neon matrices at 4 K and studied by electron spin resonance (ESR) spectroscopy and theoretical methods. It was produced by the x-irradiation of neon matrix samples containing neutral ScZ which was formed by trapping the products generated fr...1993
179 Miller, Joel Steven; Epstein, Arthur J.Magnetization and dynamics of reentrant ferrimagnetic spin-glass [MnTPP]::+[TCNE].-.2PhMeWe present direct current (dc) magnetization M(T,H) and alternating current (ac) susceptibility Xac(T,H,f) data for the quasi-one-dimensional molecule-based ferrimagnet [MnTPP]::+[TCNE].-.•2PhMe (TPP=meso-tetraphenylporphyrinato, TCNE=tetracyanoethylene). Static scaling of the real part X' of ...Ferrimagnetic order; Magnetism1996
180 Miller, Joel Steven; Epstein, Arthur J.Effect of solvent on the magnetic properties of the high-temperature V[TCNE]x molecule-based magnetThe different magnetic behaviors of the V[TCNE]x (TCNE=tetracyanoethylene) magnet prepared via the reaction of TCNE and V(CO)6 in CH2Cl2 and the solvent-free chemical vapor deposition (CVD) of TCNE and V(CO)6 onto a glass substrate were determined. It was shown that the presence of noncoordinating C...Magnetization; Molecule2001
181 Morse, Michael DavidSpectroscopy and electronic structure of jet-cooled GaAsAn optical spectrum, obtained by resonant two-photon ionization spectroscopy, is reported for jet-cooled diatomic gallium arsenide. The ground state is identified as X??-, deriving from a ??rr? molecular configuration, and is characterized by ?" = 215 cm-1, ?"exe" = 3 cm-1, and r0' = 2.53 ? 0.02 ?. ...1989
182 Miller, Joel StevenIsolation of two salts from the reduction of TCNE with [(n-C3H7)4N]I. A further example of long 2.87 Ã pi-C-C bonding in pi-[TCNE]22-Reduction of tetracyanoethylene, TCNE, with tetrakis(n-propyl)ammonium iodide, [Pr4N]I, results in a new example of long pi*-CC bonded pi-[TCNE]22- dimers with a 2.870(4) A(°) intradimer CC bond, which is structurally and spectroscopically characterized. This reaction also results in isolation of ...Synthesis; Intradimer; Crystals2002
183 Miller, Joel StevenCluster glass state and photoinduced effects on the freezing dynamics in KxCo[Fe(CN)6]y.ZH2O (x-0.16,y-0.72, z-4.4)The magnetic properties and photoinduced magnetization of a Prussian blue analog, KxCo[Fe(Cn)6]y•ZH2O (x-0.16, y-0.72, z-4.4) were systematically studied. The frequency dependence of the linear ac susceptibility, the irreversibility in the field-cooled/ zero-field-cooled magnetization (MFC /MZFC)...Hexacyanide; Illumination; Temperatures2000
184 Miller, Joel Steven; Epstein, Arthur J.Ferromagnetism in molecular decamethylferrocenium tetracyanoethylenide: (DMeFc TCNE)The temperature and magnetic field dependence of the magnetization and susceptibility of single-crystal decamethylferrocenium tetracyanoethenide demonstrate that this material is the first molecular compound with a ferromagnetic ground state. A spontaneous magnetization is observed for T < 4.8 K. T...Magnetization; Ferromagnetic1987
185 Yang, Seung OokConstruction of a protein-based nanoreactor using charge complementarity2012
186 Miller, Joel StevenOptical properties of cesium tetracyanoquinodimethanide, Cs2(TCNQ)3Room-temperature polarized reflectance measurements have been made on cesium tetracyanoquinodimethanide, Cs2(TCNQI3, over the frequency range between the far infrared and the near ultraviolet. The optical properties of the compound were obtained by Kramers-Kronig analysis. These properties are dom...Electrons; Lattice; Molecules1981
187 Armentrout, Peter B.Reaction of Cr+, Mn+, Fe+, Co+, and Ni+ with O2 and N2O. Examination of the translational energy dependence of the cross sections of endothermic reactionsReactions of Cr+, Mn+, Fe+, Co+, and Ni+ with 02 and N20 to yield metal oxide ions are examined using an ion beam apparatus. Reaction cross sections a as a function of ion translational energy E are reported. With one exception, Fe+ + N20, the cross sections exhibit an energy threshold E0.Metal oxides; Endothermic reactions; Translational energy; Bond energy; Threshold energy1982
188 Miller, Joel StevenMagnetic behaviors of the metamagnetic and ferromagnetic phases of [Fe(C5Me5)2][TCNQ] (TCNQ = 7,7,8,8-tetracyano-p-quinodimethane). Determination of the phase diagram for the metamagnetic phaseThe detailed magnetic behaviors of the ferro- (1FO) and metamagnetic (1MM) phases of [FeCp*2][TCNE] (Cp* = pentamethylcyclopentadienide; TCNE = tetracyanoethylene) aligned parallel to the applied magnetic field, H, were obtained using eicosane (E). The Tc for 1FO is 3.1 K from the maximum in the fr...Properties; Temperature; Ordering2006
189 Miller, Joel StevenPreparation and characterization of square-planar tetrakis(cyanoacetylide) complexes: [MII(C=C-C=N)4]2- (M = Ni,Pd, Pt)Complexes [MII(C=C-=N)4]2 - (M = Ni, Pd, Pt) are prepared for the first time and the structure of [NEt4]2[Ni(C=C-C=N)4] is determined to have a square-planar geometryBonding; Structure; Ligand1996
190 Armentrout, Peter B.Supporting information for infrared multiple photon dissociation spectroscopy of cationized methionine: effects of alkali-metal cation size on gas-phase conformationA description of the structures of Met and M+(Met) for M+ = Li+, Na+, K+, Rb+, and Cs+. Two figures (S1a and S1b) depicting the 298 K Gibbs free energies calculated at the R/6- 311+G(2d,2p)//B3LYP/6-311+G(d,p) (M+ = Li+, Na+, K+) and R/HW*/6-311+G(2d,2p)// B3LYP/HW*6-311+G(d,p) (M+ = Rb+ and Cs+) le...2010
191 Poulter, Charles DaleTrisammonium geranyl diphosphateGeranyl chloride. To a flame-dried, 100-mL, three-necked, round-bottomed flask equipped with a magnetic stirrer, low temperature thermometer, rubber septum, and nitrogen inlet adapter, is added 1 .47 g (11 mmol) of N-chlorosuccinimide (Note 1) . The powder is dissolved in 45 mL of dry dichloromet...Buffer; Solution; Chloride1987
192 Stang, Peter J.Studies in the cycloproparene series: cycloaddition reactions of diarylmethylidenecycloproparenesDiarylmethylidenecyclopropanaphthalenes 4b-d add diphenylisobenzofuran (DPIBF) and α-pyrone across the exocyclic double bond to give ring expanded products 11b-d and 13b-d that result from subsequent relief of ring strain in the non-isolable spirocyclic intermediates 10 and 12, respectively. The be...Cycloproparene series; Cycloaddition; Diarylmethylidenecycloproparenes; Ab initio calculations; Strained aromatics; Acetylenic-iodonium salts; Crystal structures; Cyclobutanes, Diels-Alder cycloaddition; norcaradienes2001
193 Miller, Joel Steven; Epstein, Arthur J.Optical properties of the cation-deficient platinum chain salt K1.75Pt(CN)4¢1.5H2OThe room-temperature polarized reflectance of a potassium-deficient platinum chain salt K1.75Pt(CN)4.1.5Hz[K0 (def)CP] has been measured in the infrared and visible. The reflectance is strongly anisotropic, with a plasma edge in the red and high reflectance in the infrared for light polarized para...Reflectance; Crystals; Lattice1982
194 Armentrout, Peter B.; Morse, Michael DavidRydberg and pulsed field ionization-zero electron kinetic energy spectra of YOA spectroscopic study of the Rydberg states of YO accessed from particular rotational levels of the A²Π½, v=0 state has been combined with a pulsed field ionization, zero electron kinetic energy (PFI-ZEKE) investigation. The results provide accurate values of the ionization energy of YO, ionizati...Ionization energy; Rydberg spectra; Yttrium monoxide1999
195 Miller, Joel StevenMnII(N3)2(pyrazine).A 2-D layered structure consisting of ferromagnetically coupled 1-D {Mn(U-1,1-N3)2}n chainsMn(N3)2(pyz) (pyz = pyrazine) consists of ferromagnetically coupled linear chains of {Mn(N3)2}n comprised of u-1,1-azido bridges together with u-pyz ligands to afford 2-D planar layers.Ferromagnetic; Coupling; Magnetic1999
196 Armentrout, Peter B.Transition metal cluster ion chemistryThe reactivity and thermochemistry of ionic metal atoms and clusters has been explored using guided ion beam mass spectrometry. With this apparatus, cross sections of ion-molecule reactions can be measured from thermal energies to hundreds of eV. Application to metal cluster chemistry demonstrates...Metal clusters; Manganese ions; Endothermic reactions1986
197 Miller, Joel Steven; Epstein, Arthur J.Magnetic bistability and nucleation of magnetic bubbles in a layered 2D organic-based magnet [Fe(TCNE)(NCMe)2][FeC14]The 2D layered organic-based magnet [Fe(TCNE)(NCMe)2][FeCl4] (TCNE ¼ tetracyanoethylene) exhibits a unique macroscopic magnetic bistability between the field-cooled and zero-field-cooled states, which cannot be explained by either superparamagnetic behavior or spin freezing due to spin glass orde...Organic-based magnets; Tetracyanoethylene; Magnetic bistability; Nucleation2008-11
198 Miller, Joel Steven; Epstein, Arthur J.Ferromagnetic behavior and magnetic excitations in a molecular-based alternating-spin chain: decamethylchromocenium tetracyanoethenideWe report the study of magnetic properties of a molecular-based alternating-spin chain: metallocenium electron-transfer salt decamethylchromocenium tetracyanoethanide, [CrCp(*2)] [TCNE]. We give a modified spin-wave theory for the Heisenberg alternating-spin chains. The low-field susceptibility and...TCNE; Magnetization1994
199 Truong, ThanhCombined reaction class approach with integrated molecular orbital + molecular orbital (IMOMO) methodology: a practical tool for kinetic modelingWe present a new practical computational methodology for predicting thermal rate constants of reactions involving large molecules or a large number of elementary reactions in the same class. This methodology combines the integrated molecular orbital1molecular orbital (IMOMO) approach with our rece...IMOMO; Kinetic modeling; Thermal rate constants2000
200 Armentrout, Peter B.Translational energy dependence of Ar+ + XY → ArX+ + Y (XY = H2, D2, HD) from thermal to 30 eV c.m.Cross sections for the reactions of Ar+ with H2, D2, and HD to form ArH + and ArD + are measured using a new guided ion beam tandem mass spectrometer which affords an experimental energy range from 0.05 to 500 eV laboratory. The apparatus and experimental techniques are described in detail. Cross se...Translational energy; Ion-molecule reactions; Ion energy; Argon; Hydrogen; Endothermic reactions1985
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