LEADER 01785nam 2200397Ia 450 001 996384723003316 005 20221107142954.0 035 $a(CKB)4940000000073228 035 $a(EEBO)2240866740 035 $a(OCoLC)11415472 035 $a(EXLCZ)994940000000073228 100 $a19841121d1656 uy | 101 0 $aeng 135 $aurbn||||a|bb| 200 10$aWisdomes character and counterfeit$b[electronic resource] $edeliniated in two sermons : the one on the epistle of St. James, chap. 3.17 ; the other on the gospel of St. Matth., chap. 2.8 /$fby Nath. Hardy 210 $aLondon $cPrinted by J.G. for John Clark, and are to be sold at his shop ...$d1656 215 $a[4], 35, [4], 31 p 300 $aFirst sermon has running title: Wisdomes character ; second sermon has running title: Wisdomes counterfeit. 300 $aSecond sermon has special t.p. and separate pagination ; t.p. reads: Wisdomes counterfeit, or, Herodian policy, unmasked in a sermon ... 300 $aAdded t.p. reads: Wisdomes character, or, The Queen of graces, set forth in a sermon preached at the assizes holden at Aylesbury for the county of Buckingham, on Friday March 21 ... 1655. 300 $aDedicated "to the worshipfull George Tash, esq. High Sheriff of the county of Buckingham ..." 300 $aReproduction of original in the Harvard University Library. 330 $aeebo-0062 606 $aGod$xWisdom 606 $aSermons, English$y17th century 615 0$aGod$xWisdom. 615 0$aSermons, English 700 $aHardy$b Nathaniel$f1618-1670.$0821523 801 0$bEAK 801 1$bEAK 801 2$bUMI 801 2$bWaOLN 906 $aBOOK 912 $a996384723003316 996 $aWisdomes character and counterfeit$92374553 997 $aUNISA LEADER 04995nam 2200661Ia 450 001 9910144114403321 005 20230721003803.0 010 $a1-281-93860-2 010 $a9786611938604 010 $a0-470-40591-0 010 $a0-470-40589-9 035 $a(CKB)1000000000556009 035 $a(EBL)380439 035 $a(OCoLC)299033635 035 $a(SSID)ssj0000107348 035 $a(PQKBManifestationID)11114256 035 $a(PQKBTitleCode)TC0000107348 035 $a(PQKBWorkID)10008705 035 $a(PQKB)11056532 035 $a(MiAaPQ)EBC380439 035 $a(Au-PeEL)EBL380439 035 $a(CaPaEBR)ebr10257600 035 $a(CaONFJC)MIL193860 035 $a(EXLCZ)991000000000556009 100 $a20080520d2009 uy 0 101 0 $aeng 135 $aur|n|---||||| 181 $ctxt 182 $cc 183 $acr 200 10$aAtomic charges, bond properties, and molecular energies$b[electronic resource] /$fSa?ndor Flisza?r 210 $aHoboken, N.J. $cWiley$dc2009 215 $a1 online resource (248 p.) 300 $aDescription based upon print version of record. 311 $a0-470-37622-8 320 $aIncludes bibliographical references (p. 219-229) and index. 327 $aATOMIC CHARGES, BOND PROPERTIES, AND MOLECULAR ENERGIES; CONTENTS; PREFACE; DEDICATION AND ACKNOWLEDGMENTS; I CHARGE DISTRIBUTIONS; 1 INTRODUCTION; 1.1 The Bond Energy Model; 1.2 Scope; 2 THEORETICAL BACKGROUND; 2.1 The Hartree-Fock Approximation; 2.2 Hartree-Fock-Roothaan Orbitals; 2.3 Configuration Interaction Calculations; 3 CORE AND VALENCE ELECTRONS; 3.1 Introduction; 3.2 Atomic Core and Valence Regions; 3.3 The Valence Region Energy of Atoms; 3.4 Summary; 4 THE VALENCE REGION OF MOLECULES; 4.1 Model; 4.2 The Core-Valence Separation in Real Space 327 $a4.3 Formula for the Valence Region Energy4.4 Interface with the Orbital Model; 4.5 Approximation for the Valence Energy; 4.6 Perturbation of the Valence Region; 4.7 Summary; 5 INDUCTIVE EFFECTS; ATOMIC CHARGES; 5.1 Introduction; 5.2 The Inductive Effects; 5.3 Meaningful Atomic Charges; 5.4 Selected Reference Net Atomic Charges; 6 ATOMIC CHARGES AND NMR SHIFTS; 6.1 Scope; 6.2 Introduction; 6.3 Merits of Charge-Shift Relationships; 6.4 Aromatic Hydrocarbons; 6.5 Relationships Involving sp(3) Carbon Atoms; 6.6 Relationships Involving Olefinic Carbons; 6.7 Carbon Bonded to Nitrogen or Oxygen 327 $a6.8 Correlations Involving N-15 NMR Shifts6.9 Correlations Involving O-17 Atoms; 6.10 Summary; 7 CHARGES AND IONIZATION POTENTIALS; 7.1 Conclusion; 8 POPULATION ANALYSIS; 8.1 The Standard Mulliken Formula; 8.2 Modified Population Analysis; 8.3 An Adequate Approximation; 8.4 Conclusions; II CHEMICAL BONDS: ENERGY CALCULATIONS; 9 THERMOCHEMICAL FORMULAS; 9.1 Basic Formulas; 9.2 Zero-Point and Heat Content Energies; 9.3 Concluding Remarks; 10 THE CHEMICAL BOND: THEORY (I); 10.1 Synopsis; 10.2 Nonbonded Interactions; 10.3 Reference Bonds; 10.4 Bond Energy: Working Formulas 327 $a10.5 Basic Theoretical Parameters10.6 Saturated Molecules; 11 THE CHEMICAL BOND: THEORY (II); 11.1 Valence Atomic Orbital Centroids; 11.2 Unsaturated Systems; 11.3 Recapitulation; 12 BOND DISSOCIATION ENERGIES; 12.1 Scope; 12.2 Theory; 12.3 Nonbonded Interactions; 12.4 Selected Reorganizational Energies; 12.5 Applications; 12.6 Conclusion; III APPLICATIONS; 13 SATURATED HYDROCARBONS; 13.1 Acyclic Alkanes; 13.2 Cycloalkanes; 14 UNSATURATED HYDROCARBONS; 14.1 Olefins; 14.2 Aromatic Molecules; 15 NITROGEN-CONTAINING MOLECULES; 15.1 Amines: Charges of the Carbon Atoms 327 $a15.2 Nitrogen Charges and Bond Energies15.3 Results; 16 OXYGEN-CONTAINING MOLECULES; 16.1 Ethers; 16.2 Alcohols; 16.3 Carbonyl Compounds; 17 PERSPECTIVES; APPENDIX: WORKING FORMULAS; A.1 Charge-NMR Shift Correlations; A.2 General Energy Formulas; A.3 Bond Energy Formulas; BIBLIOGRAPHY; INDEX 330 $aThe first book to cover conceptual quantum chemistry, Atomic Charges, Bond Properties, and Molecular Energies deftly explores chemical bonds, their intrinsic energies, and the corresponding dissociation energies, which are relevant in reactivity problems. This unique first-hand, self-contained presentation develops relatively uncomplicated but physically meaningful approaches to molecular properties by providing derivations of all the required formulas from scratch, developed in Professor Fliszar's laboratory. This book is vitally relevant to organic- and biochemists, molecular biologis 606 $aChemical bonds 606 $aAtomic theory 615 0$aChemical bonds. 615 0$aAtomic theory. 676 $a541 676 $a541.224 686 $aVE 5300$2rvk 686 $aVK 5700$2rvk 700 $aFlisza?r$b Sa?ndor$069462 801 0$bMiAaPQ 801 1$bMiAaPQ 801 2$bMiAaPQ 906 $aBOOK 912 $a9910144114403321 996 $aAtomic charges, bond properties, and molecular energies$91985157 997 $aUNINA