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Results:
1-21
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Results: 21
Authors:
IVANIC J
RUEDENBERG K
Citation: J. Ivanic et K. Ruedenberg, ROTATION MATRICES FOR REAL SPHERICAL-HARMONICS - DIRECT DETERMINATIONBY RECURSION (VOL 100, PG 6342, 1996), The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(45), 1998, pp. 9099-9100
Authors:
ATCHITY GJ
RUEDENBERG K
Citation: Gj. Atchity et K. Ruedenberg, DETERMINATION OF DIABATIC STATES THROUGH ENFORCEMENT OF CONFIGURATIONAL UNIFORMITY, Theoretical chemistry accounts, 97(1-4), 1997, pp. 47-58
Authors:
ATCHITY GJ
RUEDENBERG K
Citation: Gj. Atchity et K. Ruedenberg, GLOBAL POTENTIAL-ENERGY SURFACES FOR THE LOWEST 2 (1)A' STATES OF OZONE, Theoretical chemistry accounts, 96(3), 1997, pp. 176-194
Authors:
ATCHITY GJ
RUEDENBERG K
NANAYAKKARA A
Citation: Gj. Atchity et al., THE INTERSECTION SEAM BETWEEN THE 1(1)A' AND 2(1)A' STATES OF OZONE, Theoretical chemistry accounts, 96(3), 1997, pp. 195-204
Authors:
ATCHITY GJ
RUEDENBERG K
Citation: Gj. Atchity et K. Ruedenberg, PERIMETRIC SCALE-SHAPE COORDINATES FOR TRIATOMIC-MOLECULES, Theoretical chemistry accounts, 96(3), 1997, pp. 205-211
Authors:
NIU JE
SCHWARZ WHE
RUEDENBERG K
Citation: Je. Niu et al., ELECTRON-DENSITIES AND P-PI-AO OCCUPANCIES IN PI-BONDED SYSTEMS, Journal of molecular structure. Theochem, 389(1-2), 1997, pp. 117-128
Authors:
IVANIC J
ATCHITY GJ
RUEDENBERG K
Citation: J. Ivanic et al., VIOLATION OF THE WEAK NONCROSSING RULE BETWEEN TOTALLY SYMMETRICAL CLOSED-SHELL STATES IN THE VALENCE-ISOELECTRONIC SERIES O-3, S-3, SO2, AND S2O, The Journal of chemical physics, 107(11), 1997, pp. 4307-4317
Authors:
IVANIC J
RUEDENBERG K
Citation: J. Ivanic et K. Ruedenberg, ROTATION MATRICES FOR REAL SPHERICAL-HARMONICS - DIRECT DETERMINATIONBY RECURSION, Journal of physical chemistry, 100(15), 1996, pp. 6342-6347
Authors:
SUN JQ
RUEDENBERG K
Citation: Jq. Sun et K. Ruedenberg, LOCATING TRANSITION-STATES BY QUADRATIC IMAGE GRADIENT DESCENT ON POTENTIAL-ENERGY SURFACES, The Journal of chemical physics, 101(3), 1994, pp. 2157-2167
Authors:
RUEDENBERG K
SUN JQ
Citation: K. Ruedenberg et Jq. Sun, A SIMPLE PREDICTION OF APPROXIMATE TRANSITION-STATES ON POTENTIAL-ENERGY SURFACES, The Journal of chemical physics, 101(3), 1994, pp. 2168-2174
Authors:
RUEDENBERG K
SUN JQ
Citation: K. Ruedenberg et Jq. Sun, GRADIENT FIELDS OF POTENTIAL-ENERGY SURFACES, The Journal of chemical physics, 100(8), 1994, pp. 5836-5848
Authors:
RUEDENBERG K
SUN JQ
Citation: K. Ruedenberg et Jq. Sun, QUADRATIC STEEPEST DESCENT ON POTENTIAL-ENERGY SURFACES .4. ADAPTATION TO SINGULAR HESSIANS, The Journal of chemical physics, 100(8), 1994, pp. 6101-6101
Authors:
SUN JQ
RUEDENBERG K
Citation: Jq. Sun et K. Ruedenberg, GRADIENT EXTREMALS AND STEEPEST DESCENT LINES ON POTENTIAL-ENERGY SURFACES (VOL 98, PG 9707, 1993), The Journal of chemical physics, 100(2), 1994, pp. 1779-1779
Authors:
XANTHEAS SS
RUEDENBERG K
Citation: Ss. Xantheas et K. Ruedenberg, POTENTIAL-ENERGY SURFACES OF CARBON-DIOXIDE, International journal of quantum chemistry, 49(4), 1994, pp. 409-427
Authors:
RAFFENETTI RC
RUEDENBERG K
JANSSEN CL
SCHAEFER HF
Citation: Rc. Raffenetti et al., EFFICIENT USE OF JACOBI ROTATIONS FOR ORBITAL OPTIMIZATION AND LOCALIZATION, Theoretica Chimica Acta, 86(1-2), 1993, pp. 149-165
Authors:
SUN JQ
RUEDENBERG K
Citation: Jq. Sun et K. Ruedenberg, QUADRATIC STEEPEST DESCENT ON POTENTIAL-ENERGY SURFACES .1. BASIC FORMALISM AND QUANTITATIVE ASSESSMENT, The Journal of chemical physics, 99(7), 1993, pp. 5257-5268
Authors:
SUN JQ
RUEDENBERG K
Citation: Jq. Sun et K. Ruedenberg, QUADRATIC STEEPEST DESCENT ON POTENTIAL-ENERGY SURFACES .2. REACTION-PATH FOLLOWING WITHOUT ANALYTIC HESSIANS, The Journal of chemical physics, 99(7), 1993, pp. 5269-5275
Authors:
SUN JQ
RUEDENBERG K
ATCHITY GJ
Citation: Jq. Sun et al., QUADRATIC STEEPEST DESCENT ON POTENTIAL-ENERGY SURFACES .3. MINIMA SEEKING ALONG STEEPEST DESCENT LINES, The Journal of chemical physics, 99(7), 1993, pp. 5276-5280
Authors:
ATCHITY GJ
RUEDENBERG K
Citation: Gj. Atchity et K. Ruedenberg, STRONG SHIFTS IN DIABATIC NONDYNAMIC ELECTRON CORRELATIONS CAUSE CONICAL INTERSECTION BETWEEN LOW-LYING CLOSED-SHELL ADIABATIC SINGLETS OF LIKE SYMMETRY IN OZONE, The Journal of chemical physics, 99(5), 1993, pp. 3790-3798
Authors:
RUEDENBERG K
ATCHITY GJ
Citation: K. Ruedenberg et Gj. Atchity, A QUANTUM-CHEMICAL DETERMINATION OF DIABATIC STATES, The Journal of chemical physics, 99(5), 1993, pp. 3799-3803
Authors:
SUN JQ
RUEDENBERG K
Citation: Jq. Sun et K. Ruedenberg, GRADIENT EXTREMALS AND STEEPEST DESCENT LINES ON POTENTIAL-ENERGY SURFACES, The Journal of chemical physics, 98(12), 1993, pp. 9707-9714
Risultati:
1-21
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