283. Meier RJ (2007) Vib Spectrosc 43:26–37
284. Parks HL, McGaughey AJH, Viswanathan V (2019) J Phys Chem C 123:4072–4084
285. Yang Y, Schneider PE, Culpitt T, Pavosevic F, Hammes-Schiffer S (2019) J Phys Chem Lett
10:1167–1172
286. Humason A, Zou W, Cremer D (2014) J Phys Chem A 119:1666–1682
287. Badger RM (1934) J Chem Phys 2:128–131
288. Wiberg K (1968) Tetrahedron 24:1083–1096
289. Mayer I (2007) J Comput Chem 28:204–221
290. Porterfield WW (1993) Inorganic chemistry, a unified approach. Academic Press, San Diego
291. Anderson S (2004) Introduction to inorganic chemistry. University Science Books, Sausalito
292. Runyon JW, Steinhof O, Dias HVR, Calabrese JC, Marshall WJ, Arduengo AJ (2011) Austr J
Chem 64:91165–91172
293. Arduengo AJ, Dolphin JS, Gurau G, Marshall WJ, Nelson JC, Petrov VA, Runyon JW (2013)
Angew Chem Int Ed Engl 52:5110–5114
294. Nelson DJ, Nolan SP (2013) Chem Soc Rev 42:6723–6753
295. Hopkinson MN, Richter C, Schedler M, Glorius F (2014) Nature 510:485–496
296. Dröge T, Glorius F (2010) Angew Chem Int Ed Engl 49:6940–6952
297. Nelson DJ (2015) Eur J Inorg Chem 2015(12):2012–2027
298. Valdes H, Poyatos M, Peris E (2015) Organometallics 34:1725–1729
299. Jonek M, Diekmann J, Ganter C (2015) Chem Eur J 21:15759–15768
300. Fürstner A, Alcarazo M, Krause H, Lehmann CW (2007) J Am Chem Soc 129:12676–12677
301. Majhi PK, Serin SC, Schnakenburg G, Gates DP, Streubel R (2014) Eur J Inorg Chem 2014
(29):4975–4983
302. Soleilhavoup M, Bertrand G (2014) Acc Chem Res 48(2):256–266
303. Uzelac M, Hernán-Gómez A, Armstrong DR, Kennedy AR, Hevia E (2015) Chem Sci 6
(10):5719–5728
304. Becke AD (1988) Phys Rev A 38:3098–3100
305. Perdew JP (1986) Phys Rev B 33:8822–8824
306. Dunning TH (1989) J Chem Phys 90(2):1007–1023
307. Körsgen H, Urban W, Brown JM (1999) J Chem Phys 110(8):3861–3869
308. Carroll PK, McCormack P (1972) Astrophys J 177:L33–L36
309. DeYonker NJ, Allen WD (2012) J Chem Phys 137(23):234303
310. Nakazawa H, Itazaki M (2011) Fe-H complexes in catalysis. In: Plietker B (ed) Iron catalysis:
fundamentals and applications. Springer, Berlin, pp 27–81
311. Aoto YA, de Lima Batista AP, Köhn A, de Oliveira-Filho AGS (2017) J Chem Theory
Comput 13(11):5291–5316
312. Jones NO, Beltran MR, Khanna SN, Baruah T, Pederson MR (2004) Phys Rev B 70
(16):165406
313. Li HW, Zhu M, Buckley C, Jensen T (2018) Inorganics 6(3):91–96
314. Becke AD (1993) J Chem Phys 98(7):5648–5652
315. Hay PJ, Wadt WR (1985) J Chem Phys 82(1):299–310
316. Hay PJ, Wadt WR (1985) J Chem Phys 82(1):270–283
317. Wadt WR, Hay PJ (1985) J Chem Phys 82(1):284–298
Characterizing the Metal–Ligand Bond Strength via Vibrational Spectroscopy:. . .
269
284. Parks HL, McGaughey AJH, Viswanathan V (2019) J Phys Chem C 123:4072–4084
285. Yang Y, Schneider PE, Culpitt T, Pavosevic F, Hammes-Schiffer S (2019) J Phys Chem Lett
10:1167–1172
286. Humason A, Zou W, Cremer D (2014) J Phys Chem A 119:1666–1682
287. Badger RM (1934) J Chem Phys 2:128–131
288. Wiberg K (1968) Tetrahedron 24:1083–1096
289. Mayer I (2007) J Comput Chem 28:204–221
290. Porterfield WW (1993) Inorganic chemistry, a unified approach. Academic Press, San Diego
291. Anderson S (2004) Introduction to inorganic chemistry. University Science Books, Sausalito
292. Runyon JW, Steinhof O, Dias HVR, Calabrese JC, Marshall WJ, Arduengo AJ (2011) Austr J
Chem 64:91165–91172
293. Arduengo AJ, Dolphin JS, Gurau G, Marshall WJ, Nelson JC, Petrov VA, Runyon JW (2013)
Angew Chem Int Ed Engl 52:5110–5114
294. Nelson DJ, Nolan SP (2013) Chem Soc Rev 42:6723–6753
295. Hopkinson MN, Richter C, Schedler M, Glorius F (2014) Nature 510:485–496
296. Dröge T, Glorius F (2010) Angew Chem Int Ed Engl 49:6940–6952
297. Nelson DJ (2015) Eur J Inorg Chem 2015(12):2012–2027
298. Valdes H, Poyatos M, Peris E (2015) Organometallics 34:1725–1729
299. Jonek M, Diekmann J, Ganter C (2015) Chem Eur J 21:15759–15768
300. Fürstner A, Alcarazo M, Krause H, Lehmann CW (2007) J Am Chem Soc 129:12676–12677
301. Majhi PK, Serin SC, Schnakenburg G, Gates DP, Streubel R (2014) Eur J Inorg Chem 2014
(29):4975–4983
302. Soleilhavoup M, Bertrand G (2014) Acc Chem Res 48(2):256–266
303. Uzelac M, Hernán-Gómez A, Armstrong DR, Kennedy AR, Hevia E (2015) Chem Sci 6
(10):5719–5728
304. Becke AD (1988) Phys Rev A 38:3098–3100
305. Perdew JP (1986) Phys Rev B 33:8822–8824
306. Dunning TH (1989) J Chem Phys 90(2):1007–1023
307. Körsgen H, Urban W, Brown JM (1999) J Chem Phys 110(8):3861–3869
308. Carroll PK, McCormack P (1972) Astrophys J 177:L33–L36
309. DeYonker NJ, Allen WD (2012) J Chem Phys 137(23):234303
310. Nakazawa H, Itazaki M (2011) Fe-H complexes in catalysis. In: Plietker B (ed) Iron catalysis:
fundamentals and applications. Springer, Berlin, pp 27–81
311. Aoto YA, de Lima Batista AP, Köhn A, de Oliveira-Filho AGS (2017) J Chem Theory
Comput 13(11):5291–5316
312. Jones NO, Beltran MR, Khanna SN, Baruah T, Pederson MR (2004) Phys Rev B 70
(16):165406
313. Li HW, Zhu M, Buckley C, Jensen T (2018) Inorganics 6(3):91–96
314. Becke AD (1993) J Chem Phys 98(7):5648–5652
315. Hay PJ, Wadt WR (1985) J Chem Phys 82(1):299–310
316. Hay PJ, Wadt WR (1985) J Chem Phys 82(1):270–283
317. Wadt WR, Hay PJ (1985) J Chem Phys 82(1):284–298
Characterizing the Metal–Ligand Bond Strength via Vibrational Spectroscopy:. . .
269
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