Knowledge

Robert Parr

Source đź“ť

43: 140: 550: 264:
and Chengteh Lee produced an improved DFT method which could approximate the correlation energy of systems. The LYP (for Lee–Yang–Parr) functional theory is now one of the most cited papers in the chemical literature.
545: 555: 295: 289: 565: 480: 260:(DFT) would be extremely useful in quantitative calculations of chemical and biological systems, especially those with high molecular weights. In 1988 Parr, 540: 210: 155: 312: 525: 530: 242: 126: 520: 186: 560: 64: 535: 185:
in 1947. He joined the faculty at Minnesota upon receiving his Ph.D. and remained there one year. In 1948 he moved to the
107: 79: 60: 31: 190: 86: 484: 301: 257: 202: 93: 178: 53: 405: 305: 151: 75: 515: 510: 245:
or PPP method. The PPP method differed from existing structural chemistry thinking (which advocated
206: 182: 462: 367: 359: 230: 213:, where he received appointment to an endowed professorship in 1990 and where he last taught. 452: 349: 174: 226: 167: 100: 504: 198: 261: 234: 42: 457: 440: 410: 238: 194: 17: 466: 363: 371: 354: 337: 318:
2009 - winner of American Chemical Society's Award in Theoretical Chemistry
385: 237:
systems, published in 1953. Since an identical procedure was derived by
139: 272:, one of the first books to apply quantum theory to chemical systems. 222: 138: 551:
Members of the International Academy of Quantum Molecular Science
36: 386:"His International Academy of Quantum Molecular Science page" 150:(September 22, 1921 – March 27, 2017) was an American 546:
Members of the United States National Academy of Sciences
406:"Robert Parr Obituary - Chapel Hill, NC - The Herald Sun" 201:, becoming a full professor in 1957. In 1962 he moved to 556:
Foreign fellows of the Indian National Science Academy
229:, Parr developed a method of computing approximate 67:. Unsourced material may be challenged and removed. 296:International Academy of Quantum Molecular Science 290:International Academy of Quantum Molecular Science 241:the same year, it is generally referred to as the 277:Density Functional Theory of Atoms and Molecules 270:Quantum Theory of Molecular Electronic Structure 8: 279:, now considered the basic textbook on DFT. 481:"Irving Langmuir Award in Chemical Physics" 211:University of North Carolina at Chapel Hill 156:University of North Carolina at Chapel Hill 313:United States National Academy of Sciences 456: 435: 433: 431: 429: 427: 353: 127:Learn how and when to remove this message 566:Fellows of the American Physical Society 154:who was a professor of chemistry at the 30:For other people named Robert Parr, see 27:American theoretical chemist (1921–2017) 342:Angewandte Chemie International Edition 328: 251:zero differential overlap approximation 294:1967 - Co-founded (with 4 others) the 7: 65:adding citations to reliable sources 541:Carnegie Mellon University faculty 336:Ayers, Paul; Yang, Weitao (2017). 25: 441:"2009 ACS National Award Winners" 187:Carnegie Institute of Technology 143:Portrait of Robert Ghormley Parr 41: 445:Chemical & Engineering News 256:By 1978 Parr had realized that 52:needs additional citations for 526:University of Minnesota alumni 275:In 1989 he and Yang published 249:) by advancing the concept of 177:in 1942, and then entered the 1: 338:"Robert G. Parr (1921-2017)" 32:Robert Parr (disambiguation) 582: 531:American physical chemists 315:Award in Chemical Sciences 191:Carnegie Mellon University 29: 485:American Chemical Society 458:10.1021/cen-v087n003.p072 302:American Chemical Society 258:density functional theory 247:maximum overlap principle 243:Pariser–Parr–Pople method 203:Johns Hopkins University 521:Brown University alumni 268:In 1963 Parr published 217:Achievements and awards 181:, receiving a Ph.D. in 179:University of Minnesota 166:Parr received an A. B. 561:Computational chemists 355:10.1002/anie.201705477 144: 306:Irving Langmuir Award 209:, and in 1974 to the 142: 536:Theoretical chemists 148:Robert Ghormley Parr 61:improve this article 308:in Chemical Physics 207:Baltimore, Maryland 152:theoretical chemist 451:(3): 72–76. 2009. 231:molecular orbitals 183:physical chemistry 145: 311:2004 - winner of 300:1994 - Winner of 283:Awards and honors 137: 136: 129: 111: 16:(Redirected from 573: 495: 494: 492: 491: 477: 471: 470: 460: 437: 422: 421: 419: 418: 402: 396: 395: 393: 392: 382: 376: 375: 357: 333: 175:Brown University 132: 125: 121: 118: 112: 110: 69: 45: 37: 21: 581: 580: 576: 575: 574: 572: 571: 570: 501: 500: 499: 498: 489: 487: 479: 478: 474: 439: 438: 425: 416: 414: 404: 403: 399: 390: 388: 384: 383: 379: 335: 334: 330: 325: 285: 227:Rudolph Pariser 219: 171:magna cum laude 164: 133: 122: 116: 113: 70: 68: 58: 46: 35: 28: 23: 22: 15: 12: 11: 5: 579: 577: 569: 568: 563: 558: 553: 548: 543: 538: 533: 528: 523: 518: 513: 503: 502: 497: 496: 472: 423: 397: 377: 327: 326: 324: 321: 320: 319: 316: 309: 298: 292: 288:Member of the 284: 281: 218: 215: 163: 160: 135: 134: 49: 47: 40: 26: 24: 18:Robert G. Parr 14: 13: 10: 9: 6: 4: 3: 2: 578: 567: 564: 562: 559: 557: 554: 552: 549: 547: 544: 542: 539: 537: 534: 532: 529: 527: 524: 522: 519: 517: 514: 512: 509: 508: 506: 486: 482: 476: 473: 468: 464: 459: 454: 450: 446: 442: 436: 434: 432: 430: 428: 424: 413: 412: 407: 401: 398: 387: 381: 378: 373: 369: 365: 361: 356: 351: 348:(36): 10639. 347: 343: 339: 332: 329: 322: 317: 314: 310: 307: 303: 299: 297: 293: 291: 287: 286: 282: 280: 278: 273: 271: 266: 263: 259: 254: 252: 248: 244: 240: 239:John A. Pople 236: 232: 228: 224: 221:Working with 216: 214: 212: 208: 204: 200: 196: 192: 188: 184: 180: 176: 172: 169: 161: 159: 157: 153: 149: 141: 131: 128: 120: 117:February 2013 109: 106: 102: 99: 95: 92: 88: 85: 81: 78: â€“  77: 76:"Robert Parr" 73: 72:Find sources: 66: 62: 56: 55: 50:This article 48: 44: 39: 38: 33: 19: 488:. Retrieved 475: 448: 444: 415:. Retrieved 409: 400: 389:. Retrieved 380: 345: 341: 331: 276: 274: 269: 267: 255: 250: 246: 220: 199:Pennsylvania 170: 165: 147: 146: 123: 114: 104: 97: 90: 83: 71: 59:Please help 54:verification 51: 516:2017 deaths 511:1921 births 262:Weitao Yang 235:pi electron 505:Categories 490:2017-09-12 417:2017-09-12 411:Legacy.com 391:2017-09-12 323:References 195:Pittsburgh 87:newspapers 467:0009-2347 364:1433-7851 372:28776903 225:chemist 101:scholar 465:  370:  362:  223:DuPont 168:degree 162:Career 103:  96:  89:  82:  74:  193:) in 189:(now 173:from 108:JSTOR 94:books 463:ISSN 368:PMID 360:ISSN 233:for 80:news 453:doi 350:doi 304:'s 205:in 63:by 507:: 483:. 461:. 449:87 447:. 443:. 426:^ 408:. 366:. 358:. 346:56 344:. 340:. 253:. 197:, 158:. 493:. 469:. 455:: 420:. 394:. 374:. 352:: 130:) 124:( 119:) 115:( 105:· 98:· 91:· 84:· 57:. 34:. 20:)

Index

Robert G. Parr
Robert Parr (disambiguation)

verification
improve this article
adding citations to reliable sources
"Robert Parr"
news
newspapers
books
scholar
JSTOR
Learn how and when to remove this message

theoretical chemist
University of North Carolina at Chapel Hill
degree
Brown University
University of Minnesota
physical chemistry
Carnegie Institute of Technology
Carnegie Mellon University
Pittsburgh
Pennsylvania
Johns Hopkins University
Baltimore, Maryland
University of North Carolina at Chapel Hill
DuPont
Rudolph Pariser
molecular orbitals

Text is available under the Creative Commons Attribution-ShareAlike License. Additional terms may apply.

↑