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  • Nicholas C Handy FRS
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  • Nicholas C Handy FRS Publications (1991)


    ANHARMONIC VIBRATIONAL PROPERTIES OF CH2F2 - A COMPARISON OF THEORY AND EXPERIMENT
    AMOS RD, HANDY NC, GREEN WH, JAYATILAKA D, WILLETTS A, PALMIERI P
    J CHEM PHYS, 1991, 11, 8323-8336.


    HIGHER ANALYTIC DERIVATIVES.2. THE 4TH DERIVATIVE OF SELF-CONSISTENT-FIELD ENERGY
    MASLEN PE, JAYATILAKA D, COLWELL SM, AMOS RD, HANDY NC
    J CHEM PHYS, 1991, 10, 7409-7417.


    RESTRICTED MOLLER-PLESSET THEORY FOR OPEN-SHELL MOLECULES
    KNOWLES PJ, ANDREWS JS, AMOS RD, HANDY NC, POPLE JA
    CHEM PHYS LETT, 1991, 02-Mar, 130-136.


    GRADIENT THEORY APPLIED TO THE BRUECKNER DOUBLES METHOD
    KOBAYASHI R, HANDY NC, AMOS RD, TRUCKS GW, FRISCH MJ, POPLE JA
    J CHEM PHYS, 1991, 9, 6723-6733.


    OPEN-SHELL MOLLER-PLESSET PERTURBATION-THEORY
    AMOS RD, ANDREWS JS, HANDY NC, KNOWLES PJ
    CHEM PHYS LETT, 1991, 03-Apr, 256-264.


    THE ANALYTIC GRADIENT OF THE PERTURBATIVE TRIPLE EXCITATIONS CORRECTION TO THE BRUECKNER DOUBLES METHOD
    KOBAYASHI R, AMOS RD, HANDY NC
    CHEM PHYS LETT, 1991, 01-Mar, 195-202.


    SPIN CONTAMINATION IN SINGLE-DETERMINANT WAVE-FUNCTIONS
    ANDREWS JS, JAYATILAKA D, BONE RGA, HANDY NC, AMOS RD
    CHEM PHYS LETT, 1991, 5, 423-431.


    VARIATIONAL ROVIBRATIONAL STUDIES OF 3-ATOM AND 4-ATOM MOLECULES
    HANDY NC
    ABSTR PAP AM CHEM S, 1991, 30-PHYS.


    FREQUENCY-DEPENDENT HYPERPOLARIZABILITIES
    RICE JE, HANDY NC
    ABSTR PAP AM CHEM S, 1991, 342-PHYS.


    VIBRATION-ROTATION COORDINATES AND KINETIC-ENERGY OPERATORS FOR POLYATOMIC-MOLECULES
    BRAMLEY MJ, GREEN WH, HANDY NC
    MOL PHYS, 1991, 6, 1183-1208.


    A STUDY OF THE GROUND ELECTRONIC STATE OF DISULPHANE
    SU MD, WILLETTS A, BRAMLEY MJ, HANDY NC
    MOL PHYS, 1991, 6, 1209-1233.


    HIGHER ANALYTIC DERIVATIVES.1. A NEW IMPLEMENTATION FOR THE 3RD DERIVATIVE OF THE SCF ENERGY
    COLWELL SM, JAYATILAKA D, MASLEN PE, AMOS RD, HANDY NC
    INT J QUANTUM CHEM, 1991-08, 2, 179-199.


    SOME INVESTIGATIONS OF THE MP2-R12 METHOD
    BEARPARK MJ, HANDY NC, AMOS RD, MASLEN PE
    THEOR CHIM ACTA, 1991-07, 5, 361-372.


    THE CALCULATION OF FREQUENCY-DEPENDENT POLARIZABILITIES AS PSEUDO-ENERGY DERIVATIVES
    RICE JE, HANDY NC
    J CHEM PHYS, 1991, 7, 4959-4971.


    THEORETICAL ASSIGNMENT OF THE VISIBLE SPECTRUM OF SINGLET METHYLENE
    GREEN WH, HANDY NC, KNOWLES PJ, CARTER S
    J CHEM PHYS, 1991, 1, 118-132.


    TRANSITION-STATES FROM MOLECULAR SYMMETRY GROUPS - ANALYSIS OF NONRIGID ACETYLENE TRIMER
    BONE RGA, ROWLANDS TW, HANDY NC, STONE AJ
    MOL PHYS, 1991-01, 1, 33-73.



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