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Results: 1-25 | 26-30
Results: 1-25/30
SIZE AND CHARGE EFFECTS ON THE STRUCTURAL STABILITY OF LIMO2 (M = TRANSITION-METAL) COMPOUNDS
Authors: WU EJ TEPESCH PD CEDER G
Citation: Ej. Wu et al., SIZE AND CHARGE EFFECTS ON THE STRUCTURAL STABILITY OF LIMO2 (M = TRANSITION-METAL) COMPOUNDS, Philosophical magazine. B. Physics of condensed matter.Statistical mechanics, electronic, optical and magnetic, 77(4), 1998, pp. 1039-1047
LITHIUM-INTERCALATION OXIDES FOR RECHARGEABLE BATTERIES
Authors: CEDER G VANDERVEN A AYDINOL MK
Citation: G. Ceder et al., LITHIUM-INTERCALATION OXIDES FOR RECHARGEABLE BATTERIES, JOM (1989), 50(9), 1998, pp. 35-40
COMPUTATION OF ALLOY PHASE-DIAGRAMS AT LOW-TEMPERATURES
Authors: KOHAN AF TEPESCH PD CEDER G WOLVERTON C
Citation: Af. Kohan et al., COMPUTATION OF ALLOY PHASE-DIAGRAMS AT LOW-TEMPERATURES, Computational materials science, 9(3-4), 1998, pp. 389-396
THE ELECTROCHEMICAL STABILITY OF LITHIUM-METAL OXIDES AGAINST METAL REDUCTION
Authors: CEDER G AYDINOL MK
Citation: G. Ceder et Mk. Aydinol, THE ELECTROCHEMICAL STABILITY OF LITHIUM-METAL OXIDES AGAINST METAL REDUCTION, Solid state ionics, 109(1-2), 1998, pp. 151-157
FIRST-PRINCIPLES INVESTIGATION OF PHASE-STABILITY IN LIXCOO2
Authors: VANDERVEN A AYDINOL MK CEDER G KRESSE G HAFNER J
Citation: A. Vanderven et al., FIRST-PRINCIPLES INVESTIGATION OF PHASE-STABILITY IN LIXCOO2, Physical review. B, Condensed matter, 58(6), 1998, pp. 2975-2987
CHARGE-TRANSFER IN MULTICOMPONENT OXIDES
Authors: KOHAN AF CEDER G
Citation: Af. Kohan et G. Ceder, CHARGE-TRANSFER IN MULTICOMPONENT OXIDES, Physical review. B, Condensed matter, 57(7), 1998, pp. 3838-3843
COMPUTATIONAL MATERIALS SCIENCE - PREDICTING PROPERTIES FROM SCRATCH
Authors: CEDER G
Citation: G. Ceder, COMPUTATIONAL MATERIALS SCIENCE - PREDICTING PROPERTIES FROM SCRATCH, Science, 280(5366), 1998, pp. 1099-1100
FIRST-PRINCIPLES COMPUTATION OF THE VIBRATIONAL ENTROPY OF ORDERED AND DISORDERED NI3AL
Authors: VANDEWALLE A CEDER G WAGHMARE UV
Citation: A. Vandewalle et al., FIRST-PRINCIPLES COMPUTATION OF THE VIBRATIONAL ENTROPY OF ORDERED AND DISORDERED NI3AL, Physical review letters, 80(22), 1998, pp. 4911-4914
IDENTIFICATION OF CATHODE MATERIALS FOR LITHIUM BATTERIES GUIDED BY FIRST-PRINCIPLES CALCULATIONS
Authors: CEDER G CHIANG YM SADOWAY DR AYDINOL MK JANG YI HUANG B
Citation: G. Ceder et al., IDENTIFICATION OF CATHODE MATERIALS FOR LITHIUM BATTERIES GUIDED BY FIRST-PRINCIPLES CALCULATIONS, Nature, 392(6677), 1998, pp. 694-696
FIRST-PRINCIPLES EVIDENCE FOR STAGE ORDERING IN LIXCOO2
Authors: VANDERVEN A AYDINOL MK CEDER G
Citation: A. Vanderven et al., FIRST-PRINCIPLES EVIDENCE FOR STAGE ORDERING IN LIXCOO2, Journal of the Electrochemical Society, 145(6), 1998, pp. 2149-2155
THERMODYNAMICS OF OXIDES WITH SUBSTITUTIONAL DISORDER - A MICROSCOPICMODEL AND EVALUATION OF IMPORTANT ENERGY CONTRIBUTIONS
Authors: CEDER G KOHAN AF AYDINOL MK TEPESCH PD VANDERVEN A
Citation: G. Ceder et al., THERMODYNAMICS OF OXIDES WITH SUBSTITUTIONAL DISORDER - A MICROSCOPICMODEL AND EVALUATION OF IMPORTANT ENERGY CONTRIBUTIONS, Journal of the American Ceramic Society, 81(3), 1998, pp. 517-525
PRESSURE-THERMODYNAMIC STUDY OF GRAIN-BOUNDARIES - BI SEGREGATION IN ZNO
Authors: LEE JR CHIANG YM CEDER G
Citation: Jr. Lee et al., PRESSURE-THERMODYNAMIC STUDY OF GRAIN-BOUNDARIES - BI SEGREGATION IN ZNO, Acta materialia, 45(3), 1997, pp. 1247-1257
CALCULATION OF TOTAL ENERGIES IN MULTICOMPONENT OXIDES
Authors: KOHAN AF CEDER G
Citation: Af. Kohan et G. Ceder, CALCULATION OF TOTAL ENERGIES IN MULTICOMPONENT OXIDES, Computational materials science, 8(1-2), 1997, pp. 142-152
APPLICATION OF FIRST-PRINCIPLES CALCULATIONS TO THE DESIGN OF RECHARGEABLE LI-BATTERIES
Authors: CEDER G AYDINOL MK KOHAN AF
Citation: G. Ceder et al., APPLICATION OF FIRST-PRINCIPLES CALCULATIONS TO THE DESIGN OF RECHARGEABLE LI-BATTERIES, Computational materials science, 8(1-2), 1997, pp. 161-169
AB-INITIO CALCULATION OF THE INTERCALATION VOLTAGE OF LITHIUM TRANSITION-METAL OXIDE ELECTRODES FOR RECHARGEABLE BATTERIES
Authors: AYDINOL MK KOHAN AF CEDER G
Citation: Mk. Aydinol et al., AB-INITIO CALCULATION OF THE INTERCALATION VOLTAGE OF LITHIUM TRANSITION-METAL OXIDE ELECTRODES FOR RECHARGEABLE BATTERIES, Journal of power sources, 68(2), 1997, pp. 664-668
AB-INITIO STUDY OF LITHIUM INTERCALATION IN METAL-OXIDES AND METAL DICHALCOGENIDES
Authors: AYDINOL MK KOHAN AF CEDER G CHO K JOANNOPOULOS J
Citation: Mk. Aydinol et al., AB-INITIO STUDY OF LITHIUM INTERCALATION IN METAL-OXIDES AND METAL DICHALCOGENIDES, Physical review. B, Condensed matter, 56(3), 1997, pp. 1354-1365
FIRST-PRINCIPLES PREDICTION OF INSERTION POTENTIALS IN LI-MN OXIDES FOR SECONDARY LI BATTERIES
Authors: AYDINOL MK CEDER G
Citation: Mk. Aydinol et G. Ceder, FIRST-PRINCIPLES PREDICTION OF INSERTION POTENTIALS IN LI-MN OXIDES FOR SECONDARY LI BATTERIES, Journal of the Electrochemical Society, 144(11), 1997, pp. 3832-3835
FATAL POISONINGS IN YOUNG DRUG-ADDICTS IN THE NORDIC COUNTRIES - A COMPARISON BETWEEN 1984-1985 AND 1991
Authors: STEENTOFT A TEIGE B HOLMGREN P VUORI E KRISTINSSON J KAA E WETHE G CEDER G PIKKARAINEN J SIMONSEN KW
Citation: A. Steentoft et al., FATAL POISONINGS IN YOUNG DRUG-ADDICTS IN THE NORDIC COUNTRIES - A COMPARISON BETWEEN 1984-1985 AND 1991, Forensic science international, 78(1), 1996, pp. 29-37
TIGHT-BINDING CALCULATION OF FORMATION ENERGIES IN MULTICOMPONENT OXIDES - APPLICATION TO THE MGO-CAO PHASE-DIAGRAM
Authors: KOHAN AF CEDER G
Citation: Af. Kohan et G. Ceder, TIGHT-BINDING CALCULATION OF FORMATION ENERGIES IN MULTICOMPONENT OXIDES - APPLICATION TO THE MGO-CAO PHASE-DIAGRAM, Physical review. B, Condensed matter, 54(2), 1996, pp. 805-811
CONTRIBUTION OF THE VIBRATIONAL FREE-ENERGY TO PHASE-STABILITY IN SUBSTITUTIONAL ALLOYS - METHODS AND TRENDS
Authors: GARBULSKY GD CEDER G
Citation: Gd. Garbulsky et G. Ceder, CONTRIBUTION OF THE VIBRATIONAL FREE-ENERGY TO PHASE-STABILITY IN SUBSTITUTIONAL ALLOYS - METHODS AND TRENDS, Physical review. B, Condensed matter, 53(14), 1996, pp. 8993-9001
3-DIMENSIONAL EPITAXY - THERMODYNAMIC STABILITY RANGE OF COHERENT GERMANIUM NANOCRYSTALLITES IN SILICON
Authors: BALASUBRAMANIAN S CEDER G KOLENBRANDER KD
Citation: S. Balasubramanian et al., 3-DIMENSIONAL EPITAXY - THERMODYNAMIC STABILITY RANGE OF COHERENT GERMANIUM NANOCRYSTALLITES IN SILICON, Journal of applied physics, 79(8), 1996, pp. 4132-4136
A MODEL TO COMPUTE PHASE-DIAGRAMS IN OXIDES WITH EMPIRICAL OR FIRST-PRINCIPLES ENERGY METHODS AND APPLICATION TO THE SOLUBILITY LIMITS IN THE CAO-MGO SYSTEM
Authors: TEPESCH PD KOHAN AE GARBULSKY GD CEDER G COLEY C STOKES HT BOYER LL MEHL MJ BURTON BP CHO KJ JOANNOPOULOS J
Citation: Pd. Tepesch et al., A MODEL TO COMPUTE PHASE-DIAGRAMS IN OXIDES WITH EMPIRICAL OR FIRST-PRINCIPLES ENERGY METHODS AND APPLICATION TO THE SOLUBILITY LIMITS IN THE CAO-MGO SYSTEM, Journal of the American Ceramic Society, 79(8), 1996, pp. 2033-2040
NONEMPIRICAL PHASE-EQUILIBRIA IN THE W-MO-CR SYSTEM
Authors: MCCORMACK R DEFONTAINE D WOLVERTON C CEDER G
Citation: R. Mccormack et al., NONEMPIRICAL PHASE-EQUILIBRIA IN THE W-MO-CR SYSTEM, Physical review. B, Condensed matter, 51(22), 1995, pp. 15808-15822
CONVERGENT REAL-SPACE CLUSTER-EXPANSION FOR CONFIGURATIONAL DISORDER IN IONIC SYSTEMS
Authors: CEDER G GARBULSKY GD TEPESCH PD
Citation: G. Ceder et al., CONVERGENT REAL-SPACE CLUSTER-EXPANSION FOR CONFIGURATIONAL DISORDER IN IONIC SYSTEMS, Physical review. B, Condensed matter, 51(17), 1995, pp. 11257-11261
LINEAR-PROGRAMMING METHOD FOR OBTAINING EFFECTIVE CLUSTER INTERACTIONS IN ALLOYS FROM TOTAL-ENERGY CALCULATIONS - APPLICATION TO THE FCC PD-V SYSTEM
Authors: GARBULSKY GD CEDER G
Citation: Gd. Garbulsky et G. Ceder, LINEAR-PROGRAMMING METHOD FOR OBTAINING EFFECTIVE CLUSTER INTERACTIONS IN ALLOYS FROM TOTAL-ENERGY CALCULATIONS - APPLICATION TO THE FCC PD-V SYSTEM, Physical review. B, Condensed matter, 51(1), 1995, pp. 67-72
Risultati: 1-25 | 26-30