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Results: 1-25/33
Authors:
HATTIG C
Citation: C. Hattig, DISPERSION FORMULAS FOR HYPERPOLARIZABILITY AVERAGES, Molecular physics, 94(3), 1998, pp. 455-460
Authors:
HATTIG C
KOCH H
JORGENSEN P
Citation: C. Hattig et al., COMMENT ON FREQUENCY-DEPENDENT EQUATION-OF-MOTION COUPLED-CLUSTER HYPERPOLARIZABILITIES - RESOLUTION OF THE DISCREPANCY BETWEEN THEORY AND EXPERIMENT FOR HF [J-CHEM-PHYS 107,10823(1997)], The Journal of chemical physics, 109(8), 1998, pp. 3293-3295
Authors:
HATTIG C
JORGENSEN P
Citation: C. Hattig et P. Jorgensen, COUPLED-CLUSTER CALCULATIONS OF THE FREQUENCY-DEPENDENT 2ND HYPERPOLARIZABILITIES OF NE, AR, N-2, AND CH4, The Journal of chemical physics, 109(7), 1998, pp. 2762-2778
Authors:
HATTIG C
JORGENSEN P
Citation: C. Hattig et P. Jorgensen, DERIVATION OF COUPLED-CLUSTER EXCITED-STATES RESPONSE FUNCTIONS AND MULTIPHOTON TRANSITION MOMENTS BETWEEN 2 EXCITED-STATES AS DERIVATIVES OF VARIATIONAL FUNCTIONALS, The Journal of chemical physics, 109(21), 1998, pp. 9219-9236
Authors:
HATTIG C
CHRISTIANSEN O
CORIANI S
JORGENSEN P
Citation: C. Hattig et al., STATIC AND FREQUENCY-DEPENDENT POLARIZABILITIES OF EXCITED SINGLET-STATES USING COUPLED-CLUSTER RESPONSE THEORY, The Journal of chemical physics, 109(21), 1998, pp. 9237-9243
Authors:
HATTIG C
KOCH H
JORGENSEN P
Citation: C. Hattig et al., COMMENT ON RESPONSE TO COMMENT ON FREQUENCY-DEPENDENT EQUATION-OF-MOTION COUPLED-CLUSTER HYPERPOLARIZABILITIES - RESOLUTION OF THE DISCREPANCY BETWEEN THEORY AND EXPERIMENT FOR HF [J. CHEM. PHYS. 109, 9201 (1998)], The Journal of chemical physics, 109(20), 1998, pp. 9204-9204
Authors:
CORIANI S
HATTIG C
JORGENSEN P
RIZZO A
RUUD K
Citation: S. Coriani et al., COUPLED-CLUSTER INVESTIGATION OF THE ELECTRIC-FIELD-GRADIENT-INDUCED BIREFRINGENCE OF H-2, N-2, C2H2, AND CH4, The Journal of chemical physics, 109(17), 1998, pp. 7176-7184
Authors:
CHRISTIANSEN O
HATTIG C
GAUSS J
Citation: O. Christiansen et al., POLARIZABILITIES OF CO, N-2, HF, NE, BH, AND CH-INITIO CALCULATIONS -SYSTEMATIC STUDIES OF ELECTRON CORRELATION, BASIS-SET ERRORS, AND VIBRATIONAL CONTRIBUTIONS( FROM AB), The Journal of chemical physics, 109(12), 1998, pp. 4745-4757
Authors:
HATTIG C
CHRISTIANSEN O
JORGENSEN P
Citation: C. Hattig et al., MULTIPHOTON TRANSITION MOMENTS AND ABSORPTION CROSS-SECTIONS IN COUPLED-CLUSTER RESPONSE THEORY EMPLOYING VARIATIONAL TRANSITION-MOMENT FUNCTIONALS, The Journal of chemical physics, 108(20), 1998, pp. 8331-8354
Authors:
HATTIG C
CHRISTIANSEN O
JORGENSEN P
Citation: C. Hattig et al., COUPLED-CLUSTER RESPONSE CALCULATIONS OF 2-PHOTON TRANSITION-PROBABILITY RATE CONSTANTS FOR HELIUM, NEON AND ARGON, The Journal of chemical physics, 108(20), 1998, pp. 8355-8359
Authors:
HATTIG C
HESS BA
Citation: C. Hattig et Ba. Hess, TDMP2 CALCULATION OF DYNAMIC MULTIPOLE POLARIZABILITIES AND DISPERSION COEFFICIENTS FOR THE HALOGEN ANIONS F-, CL-, BR- AND I-, The Journal of chemical physics, 108(10), 1998, pp. 3863-3870
Authors:
CHRISTIANSEN O
JORGENSEN P
HATTIG C
Citation: O. Christiansen et al., RESPONSE FUNCTIONS FROM FOURIER COMPONENT VARIATIONAL PERTURBATION-THEORY APPLIED TO A TIME-AVERAGED QUASI-ENERGY, International journal of quantum chemistry, 68(1), 1998, pp. 1-52
Authors:
HATTIG C
Citation: C. Hattig, DISPERSION FORMULAS FOR THE 2ND HYPERPOLARIZABILITY COMPONENTS GAMMA(PARALLEL-TO), GAMMA(PERPENDICULAR-TO) AND GAMMA(K), Chemical physics letters, 296(3-4), 1998, pp. 245-252
Authors:
CORIANI S
HATTIG C
JORGENSEN P
HALKIER A
RIZZO A
Citation: S. Coriani et al., COUPLED-CLUSTER CALCULATIONS OF VERDET CONSTANTS (VOL. 281, PG. 445, 1997), Chemical physics letters, 293(3-4), 1998, pp. 324-324
Authors:
LARSEN H
HATTIG C
OLSEN J
JORGENSEN P
Citation: H. Larsen et al., A BASIS-SET STUDY OF COUPLED-CLUSTER AND FULL CONFIGURATION-INTERACTION CALCULATIONS OF MOLECULAR ELECTRIC PROPERTIES FOR BH, Chemical physics letters, 291(5-6), 1998, pp. 536-546
Authors:
HATTIG C
JORGENSEN P
Citation: C. Hattig et P. Jorgensen, ESTIMATE OF THE EXPERIMENTAL STATIC HYPERPOLARIZABILITY OF NEON BASEDON COUPLED-CLUSTER RESPONSE CALCULATIONS, Chemical physics letters, 283(1-2), 1998, pp. 109-113
Authors:
HATTIG C
CHRISTIANSEN O
JORGENSEN P
Citation: C. Hattig et al., FREQUENCY-DEPENDENT 2ND HYPERPOLARIZABILITIES USING COUPLED-CLUSTER CUBIC RESPONSE THEORY, Chemical physics letters, 282(2), 1998, pp. 139-146
Authors:
STEIN N
HATTIG C
HESS BA
Citation: N. Stein et al., CALCULATION OF TOTAL PHOTOABSORPTION CROSS-SECTIONS OF AR, KR, N-2 AND CO, Chemical physics, 225(1-3), 1997, pp. 309-317
Authors:
HATTIG C
JANSEN G
HESS BA
ANGYAN JG
Citation: C. Hattig et al., INTERMOLECULAR INTERACTION ENERGIES BY TOPOLOGICALLY PARTITIONED ELECTRIC PROPERTIES .2. DISPERSION ENERGIES IN ONE-CENTER AND MULTICENTER MULTIPOLE EXPANSIONS, Molecular physics, 91(1), 1997, pp. 145-160
Authors:
HATTIG C
CHRISTIANSEN O
JORGENSEN P
Citation: C. Hattig et al., CAUCHY MOMENTS AND DISPERSION COEFFICIENTS USING COUPLED-CLUSTER LINEAR-RESPONSE THEORY, The Journal of chemical physics, 107(24), 1997, pp. 10592-10598
Authors:
CORIANI S
HATTIG C
JORGENSEN P
HALKIER A
RIZZO A
Citation: S. Coriani et al., COUPLED-CLUSTER CALCULATIONS OF VERDET CONSTANTS, Chemical physics letters, 281(4-6), 1997, pp. 445-451
Authors:
HATTIG C
CHRISTIANSEN O
KOCH H
JORGENSEN P
Citation: C. Hattig et al., FREQUENCY-DEPENDENT FIRST HYPERPOLARIZABILITIES USING COUPLED-CLUSTERQUADRATIC RESPONSE THEORY, Chemical physics letters, 269(5-6), 1997, pp. 428-434
Authors:
HATTIG C
Citation: C. Hattig, ON THE CALCULATION OF DERIVATIVES FOR COULOMB-TYPE INTERACTION ENERGIES AND GENERAL ANISOTROPIC PAIR POTENTIALS, Chemical physics letters, 268(5-6), 1997, pp. 521-530
Authors:
STONE AJ
HATTIG C
JANSEN G
ANGYAN JG
Citation: Aj. Stone et al., TRANSFERABILITY OF TOPOLOGICALLY PARTITIONED POLARIZABILITIES - THE CASE OF N-ALKANES, Molecular physics, 89(2), 1996, pp. 595-605
Authors:
KUNZ CF
HATTIG C
HESS BA
Citation: Cf. Kunz et al., AB-INITIO STUDY OF THE INDIVIDUAL INTERACTION ENERGY COMPONENTS IN THE GROUND-STATE OF THE MERCURY DIMER, Molecular physics, 89(1), 1996, pp. 139-156