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Results: 1-17 |
Results: 17
VARIATIONAL TRANSITION-STATE CALCULATION OF THE RATE CONSTANTS FOR THE N(S-4(U))-2(X-3-SIGMA(-)(G))-]NO(X-2-PI)+O(P-3(G)) REACTION AND ITS REVERSE BETWEEN 300 AND 5000 K(O)
Authors: SAYOS R HIJAZO J GILIBERT M GONZALEZ M
Citation: R. Sayos et al., VARIATIONAL TRANSITION-STATE CALCULATION OF THE RATE CONSTANTS FOR THE N(S-4(U))-2(X-3-SIGMA(-)(G))-]NO(X-2-PI)+O(P-3(G)) REACTION AND ITS REVERSE BETWEEN 300 AND 5000 K(O), Chemical physics letters, 284(1-2), 1998, pp. 101-108
POTENTIAL-ENERGY SURFACE OF THE O(D-1)-]2NO, O-2+N-2 REACTIONS(N2O)
Authors: LAST I AGUILAR A SAYOS R GONZALEZ M GILIBERT M
Citation: I. Last et al., POTENTIAL-ENERGY SURFACE OF THE O(D-1)-]2NO, O-2+N-2 REACTIONS(N2O), The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(7), 1997, pp. 1206-1215
3-DIMENSIONAL QUANTUM-MECHANICAL TREATMENT OF THE REACTION NE-2(+)-]NEH++H(H)
Authors: GILIBERT M BLASCO RM GONZALEZ M GIMENEZ X AGUILAR A LAST I BAER M
Citation: M. Gilibert et al., 3-DIMENSIONAL QUANTUM-MECHANICAL TREATMENT OF THE REACTION NE-2(+)-]NEH++H(H), The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(37), 1997, pp. 6821-6823
A 3-DIMENSIONAL QUANTUM-MECHANICAL STUDY OF THE H-]H-2+H+ SYSTEM - COMPETITION BETWEEN CHEMICAL-EXCHANGE AND INELASTIC PROCESSES(H2+)
Authors: LAST I GILIBERT M BAER M
Citation: I. Last et al., A 3-DIMENSIONAL QUANTUM-MECHANICAL STUDY OF THE H-]H-2+H+ SYSTEM - COMPETITION BETWEEN CHEMICAL-EXCHANGE AND INELASTIC PROCESSES(H2+), The Journal of chemical physics, 107(5), 1997, pp. 1451-1459
INFLUENCE OF THE POTENTIAL-ENERGY SURFACE ON THE REACTION CROSS-SECTION - THE K-]KF+H SYSTEM(HF)
Authors: GONZALEZ M GILIBERT M AGUILAR A SAYOS R
Citation: M. Gonzalez et al., INFLUENCE OF THE POTENTIAL-ENERGY SURFACE ON THE REACTION CROSS-SECTION - THE K-]KF+H SYSTEM(HF), Chemical physics, 200(3), 1995, pp. 289-308
A COMPARISON BETWEEN EXPERIMENTAL, QUANTUM AND QUASI-CLASSICAL PROPERTIES FOR THE N(S-4)-2(X(3)SIGMA(G))-]NO(X(2)PI)+O(P-3) REACTION(O)
Authors: GILIBERT M GIMENEZ X GONZALEZ M SAYOS R AGUILAR A
Citation: M. Gilibert et al., A COMPARISON BETWEEN EXPERIMENTAL, QUANTUM AND QUASI-CLASSICAL PROPERTIES FOR THE N(S-4)-2(X(3)SIGMA(G))-]NO(X(2)PI)+O(P-3) REACTION(O), Chemical physics, 191(1-3), 1995, pp. 1-15
QUANTUM-MECHANICAL THEORY OF REACTIVE COLLISIONS VIA ELECTRONIC NONADIABATIC TRANSITIONS - THE 3-DIMENSIONAL F(P-2(3 2), P-2(1/2))+H-2 SYSTEM AS A TEST-CASE/
Authors: GILIBERT M BAER M
Citation: M. Gilibert et M. Baer, QUANTUM-MECHANICAL THEORY OF REACTIVE COLLISIONS VIA ELECTRONIC NONADIABATIC TRANSITIONS - THE 3-DIMENSIONAL F(P-2(3 2), P-2(1/2))+H-2 SYSTEM AS A TEST-CASE/, Journal of physical chemistry, 99(43), 1995, pp. 15748-15757
DYNAMICS OF THE N(S-4)-]N-2(X (1)SIGMA(+)(G))+O(P-3) ATMOSPHERIC REACTION ON THE (3)A'' GROUND POTENTIAL-ENERGY SURFACE .3. QUANTUM DYNAMICAL STUDY AND COMPARISON WITH QUASI-CLASSICAL AND EXPERIMENTAL RESULTS(NO(X (2)PI))
Authors: AGUILAR A GILIBERT M GIMENEZ X GONZALEZ M SAYOS R
Citation: A. Aguilar et al., DYNAMICS OF THE N(S-4)-]N-2(X (1)SIGMA(+)(G))+O(P-3) ATMOSPHERIC REACTION ON THE (3)A'' GROUND POTENTIAL-ENERGY SURFACE .3. QUANTUM DYNAMICAL STUDY AND COMPARISON WITH QUASI-CLASSICAL AND EXPERIMENTAL RESULTS(NO(X (2)PI)), The Journal of chemical physics, 103(11), 1995, pp. 4496-4508
APPLICATIONS OF SQUARE-INTEGRABLE BASIS FUNCTIONS FOR SCATTERING PROBLEMS - A COMPARISON BETWEEN APPROACHES BASED ON TOEPLITZ MATRICES AND NEGATIVE IMAGINARY POTENTIALS
Authors: RON S EISENBERG E GILIBERT M BAER M
Citation: S. Ron et al., APPLICATIONS OF SQUARE-INTEGRABLE BASIS FUNCTIONS FOR SCATTERING PROBLEMS - A COMPARISON BETWEEN APPROACHES BASED ON TOEPLITZ MATRICES AND NEGATIVE IMAGINARY POTENTIALS, Physical review. A, 49(6), 1994, pp. 4549-4555
EXCHANGE PROCESSES VIA ELECTRONIC NONADIABATIC TRANSITIONS - AN ACCURATE 3-DIMENSIONAL QUANTUM-MECHANICAL STUDY OF THE F(P-2(1 2),P-2(3/2))+H-2 REACTIVE SYSTEMS/
Authors: GILIBERT M BAER M
Citation: M. Gilibert et M. Baer, EXCHANGE PROCESSES VIA ELECTRONIC NONADIABATIC TRANSITIONS - AN ACCURATE 3-DIMENSIONAL QUANTUM-MECHANICAL STUDY OF THE F(P-2(1 2),P-2(3/2))+H-2 REACTIVE SYSTEMS/, Journal of physical chemistry, 98(49), 1994, pp. 12822-12823
3-DIMENSIONAL QUANTUM-MECHANICAL STUDY OF EXOTHERMIC REACTIVE SYSTEMS(F-2 AR+H-2(+)) EMPLOYING NEGATIVE IMAGINARY ARRANGEMENT DECOUPLING POTENTIALS(H)
Authors: GILIBERT M LAST I BARAM A BAER M
Citation: M. Gilibert et al., 3-DIMENSIONAL QUANTUM-MECHANICAL STUDY OF EXOTHERMIC REACTIVE SYSTEMS(F-2 AR+H-2(+)) EMPLOYING NEGATIVE IMAGINARY ARRANGEMENT DECOUPLING POTENTIALS(H), Chemical physics letters, 221(3-4), 1994, pp. 327-331
CROSSED MOLECULAR-BEAMS STUDY OF THE M-1)+NA(3S-2)-]M+(S-1)+NA(3P-2) COLLISION SYSTEMS (M+=LI+, NA+, K+, CS+) IN THE 0.05-3.00 KEV ENERGY-RANGE((S)
Authors: AGUILAR A ALBERTI M DEANDRES J GILIBERT M GIMENEZ X GONZALEZ M LUCAS JM PRIETO M SAYOS R SOLE A
Citation: A. Aguilar et al., CROSSED MOLECULAR-BEAMS STUDY OF THE M-1)+NA(3S-2)-]M+(S-1)+NA(3P-2) COLLISION SYSTEMS (M+=LI+, NA+, K+, CS+) IN THE 0.05-3.00 KEV ENERGY-RANGE((S), Chemical physics letters, 220(3-5), 1994, pp. 267-273
ORIENTATIONAL DEPENDENCE OF THE N(S-4)-4)+O-2(X(3)SIGMA(G)-) REACTIONS - COMPARISON OF THE ANGLE-DEPENDENT LINE-OF-CENTERS MODEL WITH QUASI-CLASSICAL TRAJECTORIES(NO(X(2)PI) AND N(S)
Authors: SAYOS R AGUILAR A GILIBERT M GONZALEZ M
Citation: R. Sayos et al., ORIENTATIONAL DEPENDENCE OF THE N(S-4)-4)+O-2(X(3)SIGMA(G)-) REACTIONS - COMPARISON OF THE ANGLE-DEPENDENT LINE-OF-CENTERS MODEL WITH QUASI-CLASSICAL TRAJECTORIES(NO(X(2)PI) AND N(S), Journal of the Chemical Society. Faraday transactions, 89(17), 1993, pp. 3223-3234
A QUASI-CLASSICAL TRAJECTORY STUDY OF THE EFFECT OF THE INITIAL ROVIBRATIONAL LEVEL AND RELATIVE TRANSLATIONAL ENERGY OF REACTANTS ON THE DYNAMICS OF THE N(S-4(U))-2(X(3)SIGMA(G)(-))-]NO(X(2)PI)+O(P-3(G)) ATMOSPHERIC REACTION ON THE (2)A' GROUND POTENTIAL-ENERGY SURFACE(O)
Authors: GILIBERT M AGUILAR A GONZALEZ M SAYOS R
Citation: M. Gilibert et al., A QUASI-CLASSICAL TRAJECTORY STUDY OF THE EFFECT OF THE INITIAL ROVIBRATIONAL LEVEL AND RELATIVE TRANSLATIONAL ENERGY OF REACTANTS ON THE DYNAMICS OF THE N(S-4(U))-2(X(3)SIGMA(G)(-))-]NO(X(2)PI)+O(P-3(G)) ATMOSPHERIC REACTION ON THE (2)A' GROUND POTENTIAL-ENERGY SURFACE(O), Chemical physics, 178(1-3), 1993, pp. 287-303
QUASI-CLASSICAL TRAJECTORY STUDY OF THE N(S-4(U))-2(X 3-SIGMA-G-)-]NO(X 2-PI)+O(P-3(G)) ATMOSPHERIC REACTION ON THE (2)A' GROUND POTENTIAL-ENERGY SURFACE EMPLOYING AN ANALYTICAL SORBIE-MURRELL POTENTIAL(O)
Authors: GILIBERT M AGUILAR A GONZALEZ M SAYOS R
Citation: M. Gilibert et al., QUASI-CLASSICAL TRAJECTORY STUDY OF THE N(S-4(U))-2(X 3-SIGMA-G-)-]NO(X 2-PI)+O(P-3(G)) ATMOSPHERIC REACTION ON THE (2)A' GROUND POTENTIAL-ENERGY SURFACE EMPLOYING AN ANALYTICAL SORBIE-MURRELL POTENTIAL(O), Chemical physics, 172(1), 1993, pp. 99-115
THE APPLICATION OF TOEPLITZ MATRICES TO SCATTERING PROBLEMS
Authors: GILIBERT M BARAM A LAST I SZICHMAN H BAER M
Citation: M. Gilibert et al., THE APPLICATION OF TOEPLITZ MATRICES TO SCATTERING PROBLEMS, The Journal of chemical physics, 99(5), 1993, pp. 3503-3508
DYNAMICS OF THE N(S-4(U))-]N(2)(X(1)SIGMA(G)+)+O(P-3(G)) ATMOSPHERIC REACTION ON THE (3)A'' GROUND POTENTIAL-ENERGY SURFACE .2. THE EFFECT OF REAGENT TRANSLATIONAL, VIBRATIONAL, AND ROTATIONAL ENERGIES(NO(X(2)PI))
Authors: GILIBERT M AGUILAR A GONZALEZ M SAYOS R
Citation: M. Gilibert et al., DYNAMICS OF THE N(S-4(U))-]N(2)(X(1)SIGMA(G)+)+O(P-3(G)) ATMOSPHERIC REACTION ON THE (3)A'' GROUND POTENTIAL-ENERGY SURFACE .2. THE EFFECT OF REAGENT TRANSLATIONAL, VIBRATIONAL, AND ROTATIONAL ENERGIES(NO(X(2)PI)), The Journal of chemical physics, 99(3), 1993, pp. 1719-1733
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